m-Nitrophenyl isocyanide (2008-59-5),m-Nitrophenyl isocyanide (2008-59-5) Manufacturers & Suppliers,Synthesis,MSDS

Basic information

Name:
Benzene,1-isocyano-3-nitro-
CAS No.:
2008-59-5
Molecular Structure:
Formula:
C7H4 N2 O2
Molecular Weight:
148.13
Synonyms:
Phenylisocyanide, m-nitro- (6CI,7CI); m-Nitrophenyl isocyanide
Density:
g/cm³
Boiling Point:
°Cat760mmHg
Flash Point:
°C
Hazard Symbols:
Low toxicity by ingestion.
Safety Description:
Moderately toxic by subcutaneous route. Low toxicity by ingestion. When heated to decomposition it emits toxic vapors of NO_x. Details

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Chemistry

Molecule structure of m-Nitrophenyl isocyanide (CAS NO.2008-59-5) :

IUPAC Name: 1-isocyano-3-nitrobenzene
Molecular Weight: 148.11886 g/mol
Molecular Formula: C₇H₄N₂O₂
XLogP3: 1.2
H-Bond Acceptor: 3
Exact Mass: 148.027277
MonoIsotopic Mass: 148.027277
Topological Polar Surface Area: 47.5
Heavy Atom Count: 11
Complexity: 200
Canonical SMILES: [C-]#[N+]C1=CC(=CC=C1)[N+](=O)[O-]
InChI: InChI=1S/C7H4N2O2/c1-8-6-3-2-4-7(5-6)9(10)11/h2-5H
InChIKey: YZCSJSFXYQDTCK-UHFFFAOYSA-N
Product Categories of m-Nitrophenyl isocyanide (CAS NO.2008-59-5) : ISONITRITE

Toxicity Data With Reference

1.		orl-mus LD :>5 g/kg		USXXAM United States Patent Document. (Commissioner of Patents and Trademarks, Washington, DC 20231) #3422190 .
2.		scu-mus LD :>1 g/kg		USXXAM United States Patent Document. (Commissioner of Patents and Trademarks, Washington, DC 20231) #3422190 .

Safety Profile

Moderately toxic by subcutaneous route. Low toxicity by ingestion. When heated to decomposition it emits toxic vapors of NO_x.

Specification

m-Nitrophenyl isocyanide (CAS NO.2008-59-5) is also called 1-Isocyano-3-nitrobenzene ; Phenyl isocyanide, m-nitro- ; Benzene, 1-isocyano-3-nitro- .