CAS
40397-95-3 Purity
96%
40397-95-3 Purity
96%
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2-CHLORO-4-METHYLPHENYL ISOCYANATE 97
CAS
40398-00-3
Catalog Number
ACM40398003
Category
Other Products
Molecular Weight
167.59234
Molecular Formula
C8H6ClNO
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Specification
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
IUPAC Name
2-chloro-1-isocyanato-4-methylbenzene
Canonical SMILES
CC1=CC(=C(C=C1)N=C=O)Cl
InChI Key
QVCZOTVTRWNPAF-UHFFFAOYSA-N
Boiling Point
231-232ºC(lit.)
Melting Point
26-30ºC(lit.)
Flash Point
225 °F
Density
1.17g/cm³
EC Number
254-906-8
Exact Mass
167.01400
Hazard Statements
Xi
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
26-36
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