hexyl isothiocyanate

异硫氰酸己酯

Also known as: 1-Hexyl isothiocyanate, 1-Isothiocyanatohexane, n-Hexyl mustard oil, Hexane, 1-isothiocyanato-, Isothiocyanic acid, hexyl ester, N-HEXYL ISOTHIOCYANATE

CAS No.
4404-45-9
Jingsj CID
J-44617-2
Molecular Formula
C7H13NS
Chinese Name
异硫氰酸己酯
Molecular Weight
143.25000 g/mol
Category
Organic Acids
Last updated
8/21/2026

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Physicochemical Properties

Boiling Point136-138 °C96 mm Hg(lit.)
Density0.933 g/mL at 25 °C(lit.)
Flash Point195 °F

GHS Safety & Compliance

Acute ToxicitySignal word: Danger

Frequently Asked Questions

What is the CAS number of hexyl isothiocyanate?

4404-45-9

What are the molecular formula and molecular weight of hexyl isothiocyanate?

C7H13NS, molecular weight 143.25000 g/mol

Is hexyl isothiocyanate hazardous?

Danger

Data compiled from public chemical databases and supplier catalogs; verify specifications with suppliers before purchase. · Last updated: 8/21/2026