COC1=CC(=C(C=C1)N)C(=O)O
CAS: 6705-03-9
Name: 2-amino-5-methoxybenzoic acid
SMILES: COC1=CC(=C(C=C1)N)C(=O)O

Molecular Processing

Molecular formula
C8H9NO3
Molecular weight
167.16
Exact mass
167.0582
XLogP
0.98
TPSA
72.55
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
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
44.37

Supplementary Information

InChIKey: UMKSAURFQFUULT-UHFFFAOYSA-N
Synonyme
5-Methoxyanthranilic acidRefChem:4646292-Amino-5-methoxybenzoic acid6705-03-92-Amino-5-methoxybenzoicacid2-amino-5-methoxy-benzoic acidBenzoic acid, 2-amino-5-methoxy-MFCD000165095-methoxy anthranilic acidSCHEMBL2211413-Methoxy-6-aminobenzoic acid2-amino-5-methoxy benzoic acidSCHEMBL29380973DTXSID502989302-Amino-5-methoxybenzoic acid #2-Aminobenzoic acid, 5-methoxy-CHEBI:181435NSC126996SBB0526192-Amino-5-methoxybenzoic acid, 97%AKOS005145853AC-1669CS-W009211EBC-612765FA16047NSC-126996PS-6044SY014917DB-014019ST50408071
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