3-Chloro-2-Methylbenzoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C8H7ClO2
IUPAC Name 3-chloro-2-methyl-benzoic acid
Molecular Mass 170.593 g·mol−1
Heat of Formation -352.3 ± 16.7 kJ·mol−1
Dipole Moment 2.04 ± 1.08 D
Volume 184.6 Å 3
Surface Area 181.54 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy 2.01 ± eV
Point Group Symmetry C1
Synonyms
  • 3-chloro-o-toluic acid
  • benzoic acid, 3-chloro-2-methyl-
  • benzoic acid, 3-chloro-2-methyl- (9ci)
  • o-toluic acid, 3-chloro-
CAS Number(s)
  • 7499-08-3
InChIKey HXGHMCLCSPQMOR-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O Cl