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CAS 4430-39-1

CAS 4430-39-1 matches 0 EU annex records across Annex II–VI of Regulation 1223/2009.

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Chemical identity and properties

PubChem 2D chemical structure for CAS 4430-39-1
CAS 4430-39-1PubChem CID 165224

6-Methylthiohexyl isothiocyanate

1-isothiocyanato-6-(methylsulfanyl)hexane is a isothiocyanate that is hexane in which two of the terminal methyl hydrogens at positions 1 and 6 have been replaced by isothiocyanato and methylsulfanyl groups. It has a role as an EC 4.1.1.17 (ornithine decarboxylase) inhibitor, an Arabidopsis thaliana metabolite, an antineoplastic agent and a neuroprotective agent. It is an isothiocyanate and a methyl sulfide. It derives from a hydride of a hexane. — ChEBI

IUPAC name
1-isothiocyanato-6-methylsulfanylhexane
Molecular formula
C8H15NS2
Molecular weight
189.3 g/mol
Exact mass
189.06459183 Da
XLogP3
3.7
Topological polar surface area
69.8 Ų
Hydrogen-bond donors
0
Hydrogen-bond acceptors
3
Covalent units
1
Defined stereocentres
0

Also known as

RefChem:1040996-MHITC6-MTITC1-Isothiocyanato-6-(methylthio)hexane1-isothiocyanato-6-(methylsulfanyl)hexaneLesquerellin6-(Methylthio)hexyl isothiocyanate(6-isothiocyanatohexyl)(methyl)sulfane
16 more reported names
Hexane, 1-isothiocyanato-6-(methylthio)-C8H15NS21-ISOTHIOCYANATO-6-(METHYLSULFENYL)-HEXANE1-Isothiocyanato-6-(methylthio)-HexaneIsothiocyanic acid, 6-(methylthio)hexyl ester6-isothiocyanatohexyl methyl sulfideUNII-63844HOL2HCCRIS 84666-methyl thiohexyl isothiocyanate1-isothiocyanato-6-methylsulfanyl-hexaneFEMA NO. 4415CHEBI:136921YIBXPFAXPUDDTK-UHFFFAOYSA-NEBC-06168TN7502HY-W714137
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External database identifiers

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

Records for CAS 4430-39-1

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How CAS 4430-39-1 is used on this site

CAS 4430-39-1 is the Chemical Abstracts Service identifier used to pin this page to a specific substance. In the current dataset, 0 EU annex records share this identifier, which helps you cross-check whether the same substance appears under one regulatory context or several.

Use this page when a supplier specification, SDS or raw-material dossier gives you CAS 4430-39-1 and you need to see every linked Annex II–VI record in one place. The entry cards above are the quickest route to concentration limits, warnings, annex placement and product-type conditions.