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HomeProduct name listHEXYL ISOTHIOCYANATE

HEXYL ISOTHIOCYANATE

Synonym(s):n-Hexyl mustard oil;1-Isothiocyanatohexane

  • CAS NO.:4404-45-9
  • Empirical Formula: C7H13NS
  • Molecular Weight: 143.25
  • MDL number: MFCD00014445
  • EINECS: 224-549-2
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-07-23 13:47:40
HEXYL ISOTHIOCYANATE Structural

What is HEXYL ISOTHIOCYANATE?

Chemical properties

: Colorless to yellow liquid; sharp green, irritating aroma

Occurrence

Reported found in horseradish and radish

The Uses of HEXYL ISOTHIOCYANATE

Hexyl isothiocyanate may be used as a starting reagent in the synthesis of hexyl isocyanate.

What are the applications of Application

Hexyl isothiocyanate is an organic building block

Aroma threshold values

High strength odor, recommend smelling in a 0.01% solution or less

General Description

Hexyl isothiocyanate (n-hexyl isothiocyanate) is an isothiocyanate derivative. It has been identified as one of the components present in the oil extracted from the Cruciferae family. On heating the mixture of n-hexyl isothiocyanate and m-chlorophenyl isothiocyanate in the temperature range of 190-230°C, n-hexyl isocyanate is obtained.

Properties of HEXYL ISOTHIOCYANATE

Melting point: 83 °C
Boiling point: 136-138 °C/96 mmHg (lit.)
Density  0.929 g/mL at 25 °C (lit.)
refractive index  n20/D 1.491(lit.)
FEMA  4422 | HEXYL ISOTHIOCYANATE
Flash point: 195 °F
Odor sharp green
Sensitive  Moisture Sensitive
JECFA Number 1895
BRN  1751837
CAS DataBase Reference 4404-45-9(CAS DataBase Reference)

Safety information for HEXYL ISOTHIOCYANATE

Signal word Danger
Pictogram(s)
ghs
Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for HEXYL ISOTHIOCYANATE

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