Product Name

  • Name

    5-Nitro-1-naphthalenecarbonitrile

  • EINECS
  • CAS No. 23245-64-9
  • Article Data5
  • CAS DataBase
  • Density 1.35g/cm3
  • Solubility
  • Melting Point
  • Formula C11H6 N2 O2
  • Boiling Point 390.7°Cat760mmHg
  • Molecular Weight 198.181
  • Flash Point 190.1°C
  • Transport Information
  • Appearance
  • Safety Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 23245-64-9 (5-Nitro-1-naphthalenecarbonitrile)
  • Hazard Symbols
  • Synonyms 1-Naphthonitrile,5-nitro- (8CI); 5-Nitro-1-naphthalenecarbonitrile; 5-Nitro-1-naphthonitrile;NNN
  • PSA 69.61000
  • LogP 3.14288

5-Nitro-1-naphthonitrile Chemical Properties

Product Name: 5-Nitro-1-naphthonitrile (CAS NO.23245-64-9)


Molecular Formula: C11H6N2O2
Molecular Weight: 198.17754g/mol
Mol File: 23245-64-9.mol
Boiling point: 390.7 °C at 760 mmHg
Flash Point: 190.1 °C
Density: 1.35 g/cm3
Surface Tension: 64.8 dyne/cm
Enthalpy of Vaporization: 64.02 kJ/mol
Vapour Pressure: 2.61E-06 mmHg at 25°C
XLogP3-AA: 2.5
H-Bond Donor: 0
H-Bond Acceptor: 3
IUPAC Name: 5-nitronaphthalene-1-carbonitrile
Canonical SMILES: C1=CC(=C2C=CC=C(C2=C1)[N+](=O)[O-])C#N
InChI: InChI=1S/C11H6N2O2/c12-7-8-3-1-5-10-9(8)4-2-6-11(10)13(14)15/h1-6H 
InChIKey: KBRVGIIHDCBSDO-UHFFFAOYSA-N

5-Nitro-1-naphthonitrile Toxicity Data With Reference

1.    

mic-sat 10 µLg/plate

     EQSFAP    Environmental Quality and Safety. 4 (1975),226.
2.    

mic-sat 100 µLg/plate

     MUREAV    Mutation Research. 116 (1983),185.
3.    

mic-esc 50 µLg/plate

     MUREAV    Mutation Research. 40 (1976),19.
4.    

uns-esc 20 mg/L

     MUREAV    Mutation Research. 131 (1984),101.
5.    

dnr-bcs 20 ug/disc

     MUREAV    Mutation Research. 40 (1976),19.
6.    

mic-sat 250 µLg/plate/20M

     MUREAV    Mutation Research. 492 (2001),13.
7.    

mic-uns 1.95 mg/L/16H

     MUREAV    Mutation Research. 492 (2001),13.

5-Nitro-1-naphthonitrile Safety Profile

Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.

5-Nitro-1-naphthonitrile Specification

 5-Nitro-1-naphthonitrile ,its CAS NO. is 23245-64-9,the synonyms is 1-Naphthalenecarbonitrile, 5-nitro- ; 2-09-00-00452 (Beilstein Handbook Reference) ; 5-Nitro-1-naphthalenecarbonitrile ; BRN 1966804 ; CCRIS 9110 ; NNN .

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