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Home > Product > Heterocyclic Organic Compounds > 2-CHLORO-5-METHYLPHENYL ISOCYANATE 98

2-CHLORO-5-METHYLPHENYL ISOCYANATE 98 | CAS Number: 40398-03-6

Catalog Number
ACM40398036
Product Name
2-CHLORO-5-METHYLPHENYL ISOCYANATE 98
Structure
CAS Number
40398-03-6
IUPAC Name
1-chloro-2-isocyanato-4-methylbenzene
Synonyms
2-Chloro-5-methylphenyl isocyanate, 40398-03-6, 1-chloro-2-isocyanato-4-methylbenzene, AC1MUGIH, ACMC-20anz0, 4-Chloro-3-isocyanatotoluene, 511986_ALDRICH, CTK1D4585, 2-Chloro-5-methylphenylisocyanate, MolPort-001-794-253, AG-F-43218, KB-68492, Benzene, 1-chloro-2-isocyanato-4-methyl-, X4570
Molecular Weight
167.594
Exact Mass
167.01400
Molecular Formula
C8H6ClNO
Boiling Point
231.5ºC at 760 mmHg
Melting Point
39-42ºC(lit.)
Flash Point
220 °F
Density
1.17g/cm3
Purity
96%
SMILES
CC1=CC(=C(C=C1)Cl)N=C=O
InChIKey
VLYGFJNRCFKJOB-UHFFFAOYSA-N
H-Bond Donor
0
H-Bond Acceptor
2
Safty Description
22-26-36
Hazard Statements
Xn
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Address: Suite 212, Waverly Plaza, 755 Waverly Avenue, Holtsville, NY 11742, USA