Name: 2-chloro-4-(dimethylcarbamoyl)benzoic acid
SMILES:
CN(C)C(=O)c1ccc(C(=O)O)c(Cl)c1Molecular Processing
Molecular formula
C10H10ClNO3
Molecular weight
227.65
Exact mass
227.0349
XLogP
1.74
TPSA
57.61
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
56.43
Supplementary Information
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