Methyl 2',3',4'-Trimethoxy-4-Biphenylcarboxylate

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Properties Simple | Detailed

Formula C17H18O5
IUPAC Name methyl 4-(2,3,4-trimethoxyphenyl)benzoate
Molecular Mass 302.322 g·mol−1
Heat of Formation -630.8 ± 16.7 kJ·mol−1
Dipole Moment 5.01 ± 1.08 D
Volume 356.62 Å 3
Surface Area 325.52 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
Synonyms
  • (1,1'-biphenyl)-4-carboxylic acid, 2',3',4'-trimethoxy-, methyl ester
  • 2,3,4-tcb
  • 2,3,4-trimethoxy-4'-carbomethoxy-1,1'-biphenyl
  • 4-(2,3,4-trimethoxyphenyl)benzoic acid methyl ester
  • methyl 2',3',4'-trimethoxy-(1,1'-biphenyl)-4-carboxylate
CAS Number(s)
  • 120666-35-5
InChIKey LWCRGAVQIHCIDM-UHFFFAOYSA-N
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