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Home > Product > Heterocyclic Organic Compounds > 2-CHLORO-4-METHYLPHENYL ISOCYANATE 97

2-CHLORO-4-METHYLPHENYL ISOCYANATE 97 | CAS Number: 40398-00-3

Catalog Number
ACM40398003
Product Name
2-CHLORO-4-METHYLPHENYL ISOCYANATE 97
Structure
CAS Number
40398-00-3
EC Number
254-906-8
IUPAC Name
2-chloro-1-isocyanato-4-methylbenzene
Synonyms
3-Chloro-4-isocyanatotoluene, 568996_ALDRICH, EINECS 254-906-8, MolPort-003-937-050, 2-chloro-1-isocyanato-4-methylbenzene, 2-Chloro-4-methylphenyl isocyanate, ALBB-003051, STK502571, ZINC02509908, CID3016182, 40398-00-3
Molecular Weight
167.59234
Exact Mass
167.01400
Molecular Formula
C8H6ClNO
Boiling Point
231-232ºC(lit.)
Melting Point
26-30ºC(lit.)
Flash Point
225 °F
Density
1.17g/cm3
Purity
96%
SMILES
CC1=CC(=C(C=C1)N=C=O)Cl
InChIKey
QVCZOTVTRWNPAF-UHFFFAOYSA-N
H-Bond Donor
0
H-Bond Acceptor
2
Safty Description
26-36
Hazard Statements
Xi
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Address: Suite 212, Waverly Plaza, 755 Waverly Avenue, Holtsville, NY 11742, USA