63759-89-7
3-([(4-HYDROXYPHENYL)METHYL]AMINO)BENZOIC ACID
Name3-([(4-HYDROXYPHENYL)METHYL]AMINO)BENZOIC ACID
1Identification
【Name】
3-([(4-HYDROXYPHENYL)METHYL]AMINO)BENZOIC ACID
【CAS】
【MDL】
MFCD11177260
【English Synonyms】
【Formula】
C14 H13 N O3
【MolWeight】
243.261
【Inchi】
InChI=1S/C14H13NO3/c16-13-6-4-10(5-7-13)9-15-12-3-1-2-11(8-12)14(17)18/h1-8,15-16H,9H2,(H,17,18)
【InChIKey】
InChIKey=ZFEIQDDOCVPQRE-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)NCc2ccc(cc2)O)C(=O)O
【MOL File】
3-([(4-HYDROXYPHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-([(4-HYDROXYPHENYL)METHYL]AMINO)BENZOIC ACID.cml