Chemical Compound

3-[(4-methoxybenzyl)amino]-4-methylbenzoic acid

CAS Registry Number886632-52-6
3-[(4-methoxybenzyl)amino]-4-methylbenzoic acid chemical structure
Primary record

3-[(4-methoxybenzyl)amino]-4-methylbenzoic acid

CAS
886632-52-6
PubChem CID
17059709
SMILES
CC1=C(C=C(C=C1)C(=O)O)NCC2=CC=C(C=C2)OC
Molecular Formula
C16H17NO3
Molecular Weight
271.316
Exact Mass
271.1208
InChI
InChI=1S/C16H17NO3/c1-11-3-6-13(16(18)19)9-15(11)17-10-12-4-7-14(20-2)8-5-12/h3-9,17H,10H2,1-2H3,(H,18,19)
InChIKey
TWOXIILSJYCJJA-UHFFFAOYSA-N
LogP
3.3139
TPSA
58.56

Names and synonyms

  • 3-[(4-methoxybenzyl)amino]-4-methylbenzoic acid
  • STK511742
  • ZINC16578631
  • AKOS001480088
  • CCG-307154
  • AN-465/43411529
  • 3-[(4-methoxyphenyl)methylamino]-4-methylbenzoic acid
  • 3-{[(4-METHOXYPHENYL)METHYL]AMINO}-4-METHYLBENZOIC ACID
  • 886632-52-6