C1=CC(=C(C=C1Cl)C(=O)O)N
CAS: 635-21-2
Name: 2-amino-5-chlorobenzoic acid
SMILES: C1=CC(=C(C=C1Cl)C(=O)O)N

Molecular Processing

Molecular formula
C7H6ClNO2
Molecular weight
171.58
Exact mass
171.0087
XLogP
1.62
TPSA
63.32
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
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
Molar refractivity
42.82

Supplementary Information

InChIKey: IFXKXCLVKQVVDI-UHFFFAOYSA-N
Synonyme
2-AMINO-5-CHLOROBENZOIC ACID635-21-25-Chloroanthranilic acid5-Chloro-2-aminobenzoic acidBenzoic acid, 2-amino-5-chloro-Anthranilic acid, 5-chloro-2-carboxy-4-chloroanilineUNII-Z2Y66JMI31Z2Y66JMI31EINECS 211-230-8NSC 404157NSC-404157AI3-15229DTXSID8060901CHEBI:1668535Chloroanthranilic acidRefChem:852605Chloro2aminobenzoic acidAnthranilic acid, 5chloroBenzoic acid, 2amino5chloroDTXCID9043938Anthranilic acid, 5chloro (8CI)Anthranilic acid, 5-chloro-(8CI)IFXKXCLVKQVVDI-UHFFFAOYSA-NInChI=1/C7H6ClNO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H,10,112-Amino-5-chloro-benzoic acidMFCD00007838CHEMBL367672-Amino-5-chlorobenzoicacid5-amino-3-carboxy-1-chlorobenzene
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