Methyl 3-Methylbenzoate

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Properties Simple | Detailed

Formula C9H10O2
IUPAC Name methyl 3-methylbenzoate
Molecular Mass 150.174 g·mol−1
Heat of Formation -294.3 ± 16.7 kJ·mol−1
Dipole Moment 2.01 ± 1.08 D
Volume 187.09 Å 3
Surface Area 190.04 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
Synonyms
  • 3-methylbenzoic acid methyl ester
  • benzoic acid, 3-methyl-, methyl ester
  • m-toluic acid, methyl ester (8ci)
  • methyl m-methylbenzoate
  • tl 00192
CAS Number(s)
  • 99-36-5
InChIKey CPXCDEMFNPKOEF-UHFFFAOYSA-N
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