Name: 4-amino-2-chloro-3-methyl-benzoic acid
SMILES:
Cc1c(N)ccc(C(=O)O)c1ClMolecular 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
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