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Structure

2-(CHLOROMETHYL)PHENYL ISOCYANATE

CAS
52986-66-0
Catalog Number
ACM52986660
Category
Other Products
Molecular Weight
167.59
Molecular Formula
C8H6ClNO

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Specification

Synonyms
2-(Chloromethyl)phenyl isocyanate, 52986-66-0, ZINC02555143, ACMC-20aono, AC1MR54W, 453242_ALDRICH, CTK4J6829, GEO-00722, 1-(chloromethyl)-2-isocyanatobenzene, AKOS005257594, AG-F-81215, KB-15494, FT-0608759, I14-45487
IUPAC Name
1-(chloromethyl)-2-isocyanatobenzene
Canonical SMILES
C1=CC=C(C(=C1)CCl)N=C=O
InChI Key
XTYOTPBIDRGAML-UHFFFAOYSA-N
Boiling Point
45ºC (0.2 torr)
Flash Point
>230 °F
Density
1.241
Exact Mass
167.01400
H-Bond Acceptor
2
H-Bond Donor
0
Packing Group
III
Safety Description
S23-S26-S36/37/39-S45
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