COC(=O)C1=C(C=C(C=C1)N)O
CAS: 4136-97-4
Name: methyl 4-amino-2-hydroxybenzoate
SMILES: COC(=O)C1=C(C=C(C=C1)N)O

Molecular Processing

Molecular formula
C8H9NO3
Molecular weight
167.16
Exact mass
167.0582
XLogP
0.76
TPSA
72.55
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
43.86

Supplementary Information

InChIKey: QQOXBFUTRLDXDP-UHFFFAOYSA-N
Synonyme
Methyl p-aminosalicylateRefChem:818009223-958-3Methyl 4-Amino-2-hydroxybenzoate4136-97-4METHYL 4-AMINOSALICYLATEPas methyl esterp-Aminosalicylic acid methyl ester4-AMINOSALICYLIC ACID METHYL ESTERMFCD00088091Benzoic acid, 4-amino-2-hydroxy-, methyl estermethyl 4-amino-2-hydroxybenzenecarboxylatemethyl 4-amino-2-hydroxy-benzoateSalicylic acid, amino-, methyl ester3-hydroxy-4-methoxycarbonylanilineNSC-30263NSC-48927Amisulpride Impurity 6EINECS 223-958-3NSC 30263NSC 48927BRN 09726314-amino-2-hydroxybenzoic acid methyl esterMethyl4-Amino-2-hydroxybenzoate4-Aminosalicylic acid, methyl estermethyl 4aminosalicylate2-Hydroxy-4-aminobenzoic acid methyl estermethyl 4-amino-salicylate4-amino-2-hydroxy-benzoic acid methyl esterKKK6HU29FV
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