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Home > Product > Heterocyclic Organic Compounds > Benzene,4-isocyanato-1-methyl-2-nitro-

Benzene,4-isocyanato-1-methyl-2-nitro- | CAS Number: 13471-69-7

Catalog Number
ACM13471697
Product Name
Benzene,4-isocyanato-1-methyl-2-nitro-
Structure
CAS Number
13471-69-7
IUPAC Name
4-isocyanato-1-methyl-2-nitrobenzene
Synonyms
2-Nitro-4-isocyanatotoluene, 439975_ALDRICH, 4-Methyl-3-nitrophenylisocyanate, NSC158456, 4-Methyl-3-nitrophenyl isocyanate, CID73137, ZINC00152303, Benzene, 4-isocyanato-1-methyl-2-nitro-, AC31427, NSC 158456, 13471-69-7
Molecular Weight
178.14
Exact Mass
178.03800
Molecular Formula
C8H6 N2 O3
Boiling Point
113-118ºC3 mm Hg(lit.)
Melting Point
51-54ºC(lit.)
Flash Point
>230
Density
1.27g/cm3
Purity
96%
Appearance
yellow crystals
SMILES
CC1=C(C=C(C=C1)N=C=O)[N+](=O)[O-]
InChIKey
OIORBBLUSMONPW-UHFFFAOYSA-N
H-Bond Donor
0
H-Bond Acceptor
4
Safty Description
S7
Hazard Statements
Xn,Xi:Irritant;
WGK Germany
3
Packing Group
III
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Address: Suite 212, Waverly Plaza, 755 Waverly Avenue, Holtsville, NY 11742, USA