2-CHLORO-4-NITROTOLUENE

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 5
Total Number of Articles : 3
PubChem 8491
Molecular Formula

C7H6ClNO2

SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C7H6ClNO2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,1H3

synonyms
  • 2-CHLORO-4-NITROTOLUENE
  • 2-Chloro-1-methyl-4-nitrobenzene
  • Benzene, 2-chloro-1-methyl-4-nitro-
Click to show/hide the synonyms
Properties
Property Value
MW 171.58 g/mol
HBD 0
HBA 2
Rotatable Bond Count 0
Exact Mass 171.0087061 g/mol
Monoisotopic Mass 171.0087061 g/mol
Heavy Atom Count 11
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 157
xlogp 3.4
Topological Polar Surface Area 45.8