
- IUPAC name
- oxathiolane 2,2-dioxide
- Molecular formula
- C3H6O3S
- Molecular weight
- 122.15 g/mol
- Exact mass
- 122.00376522 Da
- XLogP3
- -0.2
- Topological polar surface area
- 51.8 Ų
- Hydrogen-bond donors
- 0
- Hydrogen-bond acceptors
- 3
- Covalent units
- 1
- Defined stereocentres
- 0
Also known as
16 more reported names
External database identifiers
- ChEBI:CHEBI:82370
- ChEMBL:CHEMBL3185243
- EPA DTXSID:DTXSID8021195
- PubMed:32659469
- PubMed:27931811
- PubMed:22923490
- PubMed:22873558
- PubMed:22686314
- PubMed:22567565
- PubMed:22498463
- PubMed:22488562
- PubMed:22052433
- PubMed:21863088
- PubMed:21730499
- PubMed:21580354
Evidence from additional scientific databases
NIH PubChem PUG-View
Attributed physical-property, hazard, environmental and use annotations.
- Boiling Point: 180 °C at 0.039 atm. Source: Hazardous Substances Data Bank (HSDB)
- Color/Form: COLORLESS LIQ OR WHITE CRYSTALS Source: Hazardous Substances Data Bank (HSDB)
- Color/Form: White, crystalline solid or a colorless liquid (above 86 degrees F). Source: Hazardous Substances Data Bank (HSDB)
- Density: 1.39 (NIOSH, 2024) - Denser than water; will sink Source: CAMEO Chemicals
- Density: SPECIFIC GRAVITY: 1.393 @ 40 °C/4 °C Source: Hazardous Substances Data Bank (HSDB)
- Density: Density (at 25 °C): 1.392 g/cm³ Source: ILO-WHO International Chemical Safety Cards (ICSCs)
- Density: 1.393 @ 40°C Source: PAC Chemical Database, U.S. Department of Energy
- Density: 1.39 Source: The National Institute for Occupational Safety and Health (NIOSH)
- Flash Point: greater than 235 °F (NIOSH, 2024) Source: CAMEO Chemicals
- Flash Point: Flash point > 235 °F Source: Haz-Map, Information on Hazardous Chemicals and Occupational Diseases
- Flash Point: >110 °C Source: ILO-WHO International Chemical Safety Cards (ICSCs)
- Flash Point: >235 °F Source: The National Institute for Occupational Safety and Health (NIOSH)
- Melting Point: 86 °F (NIOSH, 2024) Source: CAMEO Chemicals
- Melting Point: 31 °C Source: Hazardous Substances Data Bank (HSDB)
- Melting Point: 31 °C Source: ILO-WHO International Chemical Safety Cards (ICSCs)
- Melting Point: 31 °C Source: PAC Chemical Database, U.S. Department of Energy
- Melting Point: 86 °F Source: The National Institute for Occupational Safety and Health (NIOSH)
- Odor: Foul odor above 31.11 °C. Source: Hazardous Substances Data Bank (HSDB)
- Odor: Releases a fould odor as it melts. Source: Hazardous Substances Data Bank (HSDB)
- Physical Description: Propane sultone appears as white crystalline solid or a colorless liquid (above 86 °F). Releases a foul odor when melting. (NIOSH, 2024) Source: CAMEO Chemicals
- Physical Description: Liquid Source: EPA Chemical Data Reporting (CDR)
- Physical Description: White, crystalline solid or a colorless liquid (above 86 degrees F). [Note: Releases a foul odor as it melts.]; [NIOSH] Source: Haz-Map, Information on Hazardous Chemicals and Occupational Diseases
- Physical Description: WHITE CRYSTALS OR COLOURLESS LIQUID WITH CHARACTERISTIC ODOUR. Source: ILO-WHO International Chemical Safety Cards (ICSCs)
- Physical Description: White, crystalline solid or a colorless liquid (above 86 °F). [Note: Releases a foul odor as it melts.] Source: The National Institute for Occupational Safety and Health (NIOSH)
- Refractive Index: INDEX OF REFRACTION: 1.450 @ 40 °C/D Source: Hazardous Substances Data Bank (HSDB)
- Solubility: 10 % (NIOSH, 2024) Source: CAMEO Chemicals
- Solubility: READILY SOL IN KETONES, ESTERS & AROMATIC HYDROCARBONS Source: Hazardous Substances Data Bank (HSDB)
- Solubility: INSOL IN ALIPHATIC HYDROCARBONS Source: Hazardous Substances Data Bank (HSDB)
- Solubility: SOL IN WATER (100 G/L) Source: Hazardous Substances Data Bank (HSDB)
- Solubility: Solubility in water, g/100ml: 10 (moderate) Source: ILO-WHO International Chemical Safety Cards (ICSCs)
- Solubility: 10% Source: The National Institute for Occupational Safety and Health (NIOSH)
- Vapor Pressure: 0.27 [mmHg] Source: Haz-Map, Information on Hazardous Chemicals and Occupational Diseases
- IARC Carcinogenic Agent: 1,3-Propane sultone Source: International Agency for Research on Cancer (IARC)
- IARC Carcinogenic Classes: Group 2A: Probably carcinogenic to humans Source: International Agency for Research on Cancer (IARC)
- IARC Monographs: Volume 4: (1974) Some Aromatic Amines, Hydrazine and Related Substances, N-Nitroso Compounds and Miscellaneous Alkylating Agents; Volume Sup 7: Overall Evaluations of Carcinogenicity: An Updating of IARC Monographs Volumes 1 to 42, 1987; 440 pages; ISBN 92-832-1411-0 (out of print); Volume 71: (1999) Re-evaluation of Some Organic Chemicals, Hydrazine and Hydrogen Peroxide (Part 1, Part 2, Part 3); Volume 110: (2017) Some Chemicals Used as Solvents and in Polymer Manufacture Source: International Agency for Research on Cancer (IARC)
- Publication Year: 2017 Source: International Agency for Research on Cancer (IARC)
- Evaluation Year: 2014 Source: International Agency for Research on Cancer (IARC)
- Additional information: NB Overall evaluation upgraded to Group 2A with supporting evidence from other relevant data Source: International Agency for Research on Cancer (IARC)
- Exposure Routes: The substance can be absorbed into the body by inhalation, through the skin and by ingestion. Source: ILO-WHO International Chemical Safety Cards (ICSCs)
- Exposure Routes: inhalation, skin absorption, ingestion, skin and/or eye contact Source: The National Institute for Occupational Safety and Health (NIOSH)
- First Aid: Excerpt from NIOSH Pocket Guide for Propane sultone:; Eye: IRRIGATE IMMEDIATELY - If this chemical contacts the eyes, immediately wash (irrigate) the eyes with large amounts of water, occasionally lifting the lower and upper lids. Get medical attention immediately.; Skin: WATER FLUSH IMMEDIATELY - If this chemical contacts the skin, immediately flush the contaminated skin with water. If this chemical penetrates the clothing, immediately remove the clothing and flush the skin with water. Get medical attention promptly.; Breathing: RESPIRATORY SUPPORT - If a person breathes large amounts of this chemical, move the exposed person to fresh air at once. If breathing has stopped, perform artificial respiration. Keep the affected person warm and at rest. Get medical attention as soon as possible.; Swallow: MEDICAL ATTENTION IMMEDIATELY - If this chemical has been swallowed, get medical attention immediately. (NIOSH, 2024) Source: CAMEO Chemicals
- First Aid: (General first aid procedures); Eye: Irrigate immediately - If this chemical contacts the eyes, immediately wash (irrigate) the eyes with large amounts of water, occasionally lifting the lower and upper lids. Get medical attention immediately.; Skin: Water flush immediately - If this chemical contacts the skin, immediately flush the contaminated skin with water. If this chemical penetrates the clothing, immediately remove the clothing and flush the skin with water. Get medical attention promptly.; Breathing: Respiratory support; Swallow: Medical attention immediately - If this chemical has been swallowed, get medical attention immediately. Source: The National Institute for Occupational Safety and Health (NIOSH)
- Signal: Danger Source: Regulation (EC) No 1272/2008 of the European Parliament and of the Council
- GHS Hazard Statements: H302: Harmful if swallowed [Warning Acute toxicity, oral]; H312: Harmful in contact with skin [Warning Acute toxicity, dermal]; H350: May cause cancer [Danger Carcinogenicity] Source: Regulation (EC) No 1272/2008 of the European Parliament and of the Council
- Precautionary Statement Codes: P203, P264, P270, P280, P301+P317, P302+P352, P317, P318, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement) Source: Regulation (EC) No 1272/2008 of the European Parliament and of the Council
- Signal: Danger Source: European Chemicals Agency (ECHA)
- GHS Hazard Statements: H301+H311 (21.2%): Toxic if swallowed or in contact with skin [Danger Acute toxicity, oral; acute toxicity, dermal]; H301 (65.1%): Toxic if swallowed [Danger Acute toxicity, oral]; H302 (34.9%): Harmful if swallowed [Warning Acute toxicity, oral]; H311 (64.7%): Toxic in contact with skin [Danger Acute toxicity, dermal]; H312 (35.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (64.7%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (64.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H319 (16.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (64.7%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H341 (64.7%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]; H350 (100%): May cause cancer [Danger Carcinogenicity]; H412 (43.2%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard] Source: European Chemicals Agency (ECHA)
- Precautionary Statement Codes: P203, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P318, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P405, and P501 (click each P-code to see the statement) Source: European Chemicals Agency (ECHA)
- ECHA C&L Notifications Summary: Aggregated GHS information provided per 241 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.; Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. Source: European Chemicals Agency (ECHA)
- Signal: Danger Source: NITE-CMC
- GHS Hazard Statements: H301: Toxic if swallowed [Danger Acute toxicity, oral]; H311: Toxic in contact with skin [Danger Acute toxicity, dermal]; H315: Causes skin irritation [Warning Skin corrosion/irritation]; H319: Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332: Harmful if inhaled [Warning Acute toxicity, inhalation]; H341: Suspected of causing genetic defects [Warning Germ cell mutagenicity]; H350: May cause cancer [Danger Carcinogenicity]; H370: Causes damage to organs [Danger Specific target organ toxicity, single exposure]; H402: Harmful to aquatic life [Hazardous to the aquatic environment, acute hazard]; H412: Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard] Source: NITE-CMC
- Precautionary Statement Codes: P203, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P308+P316, P316, P317, P318, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P405, and P501 (click each P-code to see the statement) Source: NITE-CMC
- GHS Hazard Statements: H301: Toxic if swallowed [Danger Acute toxicity, oral]; H311: Toxic in contact with skin [Danger Acute toxicity, dermal]; H341: Suspected of causing genetic defects [Warning Germ cell mutagenicity]; H350: May cause cancer [Danger Carcinogenicity] Source: NITE-CMC
- Precautionary Statement Codes: P203, P262, P264, P270, P280, P301+P316, P302+P352, P316, P318, P321, P330, P361+P364, P405, and P501 (click each P-code to see the statement) Source: NITE-CMC
- Target Organs: Eyes, skin, respiratory system Source: The National Institute for Occupational Safety and Health (NIOSH)
- Environmental Bioconcentration: Since 1,3-propane sultone hydrolyzes rapidly in water(1,2), bioconcentration in aquatic organisms is not expected to be a significant process(SRC). Source: Hazardous Substances Data Bank (HSDB)
- Environmental Fate: TERRESTRIAL FATE: If 1,3-propane sultone is released to soil, it will be expected to rapidly hydrolyze if the soil is moist, based upon the rapid hydrolysis observed in aqueous solution(1,2,SRC). Since it rapidly hydrolyzes, adsorption to and volatilization from moist soil are not expected to be significant processes, although no data specifically regarding the fate of 1,3-propane sultone in soil were located(SRC). Source: Hazardous Substances Data Bank (HSDB)
- Environmental Fate: AQUATIC FATE: If 1,3-propane sultone is released to water, it will be expected to rapidly hydrolyze, based upon a measured rate constant of 8.2X10-2 hr-1 for hydrolysis in aqueous solution at 25 °C(1) which corresponds to a half-life of 8.5 hr(SRC). The product of hydrolysis is 3-hydroxy-1-propanesulphonic acid(2). Since it rapidly hydrolyzes, bioconcentration, volatilization, and adsorption to sediment and suspended solids are not expected to be significant processes((SRC). No data were located concerning biodegradation, but 1,3-propane sultone will probably abiotically hydrolyze significantly faster than biodegradation(SRC). Source: Hazardous Substances Data Bank (HSDB)
- Environmental Fate: ATMOSPHERIC FATE: If 1,3-propane sultone is released to the atmosphere, it will be susceptible to photooxidation via vapor phase reaction with photochemically produced hydroxyl radicals. An atmospheric half-life of 8 days at an atmospheric concentration of 5X10+5 hydroxyl radicals per cu cm has been calculated for this process based upon an estimated rate constant(1,SRC). Source: Hazardous Substances Data Bank (HSDB)
- Consumer Uses: Ion exchange agent; Conductive agent Source: EPA Chemical Data Reporting (CDR)
- Industry Uses: Ion exchange agent; Conductive agent Source: EPA Chemical Data Reporting (CDR)
- Uses: 1,3-Propane sultone is used as a chemical intermediate to introduce sulfopropyl groups into molecules and to confer water solubility and anionic character. Source: EPA Hazardous Air Pollutants
- Sources/Uses: Used as a chemical intermediate in the production of organic chemicals; [HSDB] Source: Haz-Map, Information on Hazardous Chemicals and Occupational Diseases
- Uses: 1,3-PROPANE SULTONE IS USED AS CHEMICAL INTERMEDIATE TO INTRODUCE SULFOPROPYL GROUP ... INTO MOLECULES, & TO CONFER WATER SOLUBILITY & ANIONIC CHARACTER. Source: Hazardous Substances Data Bank (HSDB)
- Uses: CHEM INT, EG, A SULFOALKYLATING AGENT (FORMER USE) Source: Hazardous Substances Data Bank (HSDB)
Mapped by: Existing checksum-valid CAS to unique PubChem CID match. Retrieved: 2026-08-31. Open source record
Scientific classifications and hazard annotations provide context and do not replace the market-specific regulatory decision shown above.
Additional source coverage and match status
| Source | Result | Checked |
|---|---|---|
| NIH PubChem PUG-View | Exact match | 2026-08-31 |
A recorded no-match is useful evidence that the source was checked; it is not a claim that the substance does not exist elsewhere.
Retrieved from NIH PubChem on 2026-09-02 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.