CAS Registry Number: 67973-80-2

Name:

Benzoic acid, 3-​amino-​5-​hydroxy-​, methyl ester
3-​Hydroxy-​5-​aminobenzoic acid methyl ester; Methyl 3-​amino-​5-​hydroxybenzoate 

Chemical Formula: C8H9NO3
Exact Mass: 167.06
Molecular Weight: 167.16
m/z: 167.06 (100.0%), 168.06 (9.2%)
Elemental Analysis: C, 57.48; H, 5.43; N, 8.38; O, 28.71

InChI: InChI=1S/C8H9NO3/c1-12-8(11)5-2-6(9)4-7(10)3-5/h2-4,10H,9H2,1H3
InChIKey: DMNGQQIFOZYIRA-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=CC(=CC(=C1)O)N

Specification

98%

(1) von Delius, Max; Nature Chemistry 2010, V2(2), P96-101 CAPLUS
(2) Scholz, U.; Science of Synthesis 2007, V31b, P1565-1678 CAPLUS