-
Name
Methylnitrosocarbamic acid 2-chlorophenyl ester
- EINECS
- CAS No. 58169-97-4
- Density 1.35g/cm3
- Solubility
- Melting Point
- Formula C8H7ClN2O3
- Boiling Point 279.6°Cat760mmHg
- Molecular Weight 214.62
- Flash Point 122.9°C
- Transport Information
- Appearance
- Safety Mutation data reported. Many N-nitroso compounds are carcinogens. When heated to decomposition it emits very toxic fumes of Cl− and NOx. See also N-NITROSO COMPOUNDS and CARBAMATES.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms N-Nitroso-2-chlorophenyl-N-methylcarbamate;CARBAMIC ACID,METHYLNITROSO-,o-CHLOROPHENYL ESTER;Hopcide,nitrosated;2-Chlorophenyl methylnitrosocarbamate;
- PSA 58.97000
- LogP 2.45200
Carbamic acid, methylnitroso-, o-chlorophenyl ester Chemical Properties
Molecule structure of Carbamic acid, methylnitroso-, o-chlorophenyl ester (CAS NO.58169-97-4):
IUPAC Name: (2-Chlorophenyl) N-methyl-N-nitrosocarbamate
Molecular Weight: 214.60578 g/mol
Molecular Formula: C8H7ClN2O3
Density: 1.35 g/cm3
Boiling Point: 279.6 °C at 760 mmHg
Flash Point: 122.9 °C
Index of Refraction: 1.564
Molar Refractivity: 51.38 cm3
Molar Volume: 157.8 cm3
Polarizability: 20.36×10-24 cm3
Surface Tension: 47.3 dyne/cm
Enthalpy of Vaporization: 51.83 kJ/mol
Vapour Pressure: 0.00398 mmHg at 25 °C
XLogP3: 1.9
H-Bond Acceptor: 4
Rotatable Bond Count: 2
Exact Mass: 214.01452
MonoIsotopic Mass: 214.01452
Topological Polar Surface Area: 59
Heavy Atom Count: 14
Complexity: 225
Canonical SMILES: CN(C(=O)OC1=CC=CC=C1Cl)N=O
InChI: InChI=1S/C8H7ClN2O3/c1-11(10-13)8(12)14-7-5-3-2-4-6(7)9/h2-5H,1H3
InChIKey of Carbamic acid, methylnitroso-, o-chlorophenyl ester (CAS NO.58169-97-4): WJBKULKZFAUPDR-UHFFFAOYSA-N
Carbamic acid, methylnitroso-, o-chlorophenyl ester Toxicity Data With Reference
| 1. | mmo-esc 500 ng/plate | BECTA6 Bulletin of Environmental Contamination and Toxicology. 14 (1975),389. | ||
| 2. | mrc-bcs 500 ng/plate | BECTA6 Bulletin of Environmental Contamination and Toxicology. 14 (1975),389. |
Carbamic acid, methylnitroso-, o-chlorophenyl ester Consensus Reports
EPA Genetic Toxicology Program.
Carbamic acid, methylnitroso-, o-chlorophenyl ester Safety Profile
Mutation data reported. Many N-nitroso compounds are carcinogens. When heated to decomposition it emits very toxic fumes of Cl− and NOx. See also N-NITROSO COMPOUNDS and CARBAMATES.
Carbamic acid, methylnitroso-, o-chlorophenyl ester Specification
Carbamic acid, methylnitroso-, o-chlorophenyl ester (CAS NO.58169-97-4) is also named as 2-Chlorophenyl methylnitrosocarbamate ; CCRIS 1211 ; Hopcide, nitrosated ; Hopcide, nitrosated [Japanese] ; N-Nitroso-2-chlorophenyl-N-methylcarbamate .
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