이름: 2-chloro-5-methyl-p-nitroaniline
SMILES:
Cc1cc(N)c(Cl)cc1[N+](=O)[O-]Molecular Processing
Molecular formula
C7H7ClN2O2
Molecular weight
186.6
Exact mass
186.0196
XLogP
2.14
TPSA
69.16
H-bond donors
1
H-bond acceptors
3
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
5
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
47.26
Supplementary Information
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