Methyl isothiocyanate

Methyl isothiocyanate is the organosulfur compound with the formula CH3N=C=S. This low melting colorless solid is a powerful lachrymator. As a precursor to a variety of valuable bioactive compounds, it is the most important organic isothiocyanate in industry.

Methyl isothiocyanate
Names
Preferred IUPAC name
Isothiocyanatomethane
Other names
MITC, Trapex, Trapex, Vorlex, MITC-Fume, MIT, Morton EP-161E, WN 12
Identifiers
3D model (JSmol)
ChEBI
ChEMBL
ChemSpider
ECHA InfoCard 100.008.303
EC Number
  • 209-132-5
KEGG
UNII
UN number 2477
  • InChI=1S/C2H3NS/c1-3-2-4/h1H3 Y
    Key: LGDSHSYDSCRFAB-UHFFFAOYSA-N Y
  • InChI=1/C2H3NS/c1-3-2-4/h1H3
    Key: LGDSHSYDSCRFAB-UHFFFAOYAS
  • S=C=NC
Properties
C2H3NS
Molar mass 73.12
Appearance colourless solid
Density 1.07 g cm−3
Melting point 31 °C (88 °F; 304 K)
Boiling point 117 °C (243 °F; 390 K)
8.2g/l
Hazards
GHS labelling:
Danger
H301, H314, H317, H331, H410
P260, P261, P264, P270, P271, P272, P273, P280, P301+P310, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P311, P321, P330, P333+P313, P363, P391, P403+P233, P405, P501
NFPA 704 (fire diamond)
3
1
1
Safety data sheet (SDS) ACC# 07204
Structure
3.528 D
Related compounds
Related compounds
Methyl isocyanate
Methyl thiocyanate
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
N verify (what is YN ?)
Infobox references
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