CC1(C)Cc2c(Cl)c([N+](=O)[O-])cc(C(=O)O)c2O1
SMILES: CC1(C)Cc2c(Cl)c([N+](=O)[O-])cc(C(=O)O)c2O1

Molecular Processing

Molecular formula
C11H10ClNO5
Molecular weight
271.66
Exact mass
271.0248
XLogP
2.66
TPSA
89.67
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
63.48

Supplementary Information

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