CC1=CC(=CC(=C1N)C(=O)O)Cl
CAS: 20776-67-4
Nombre: 2-amino-5-chloro-3-methylbenzoic acid
SMILES: CC1=CC(=CC(=C1N)C(=O)O)Cl

Molecular Processing

Molecular formula
C8H8ClNO2
Molecular weight
185.61
Exact mass
185.0244
XLogP
1.93
TPSA
63.32
H-bond donors
2
H-bond acceptors
2
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
47.56

Supplementary Information

InChIKey: KOPXCQUAFDWYOE-UHFFFAOYSA-N
Sinónimos
2-Amino-5-chloro-3-methylbenzoic acid20776-67-4DTXSID00469911RefChem:85256DTXCID00420729629-058-0Benzoic acid, 2-amino-5-chloro-3-methyl-MFCD023588952-amino-5-chloro-3-methyl-benzoic Acid2-amino-3-methyl-5-chlorobenzoic acid3-METHYL-5-CHLORO-ANTHRANILIC ACID5-Chloro-3-methylanthranilic Acid2-Amino-5-chloro-3-methylbenzoic Acid; 2-Amino-3-methyl-5-chlorobenzoic Acid; 3-Methyl-5-chloroanthranilic AcidOprea1_371235SCHEMBL219922SCHEMBL299175662-Amino-5-chloro-m-toluic AcidAC-038CX1166AKOS009259852CS-W0029402-amino- 3-methyl-5-chlorobenzoic acid2-amino-3-methyl-5- chlorobenzoic acid2-Amino-5-chloro-3-methyl benzoic acidAS-16140FA139582SY011484DB-005175A23992-Amino-5-chloro-3-methylbenzoic acid, 97%
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