O=C(O)c1ccc(CCl)cc1
SMILES: O=C(O)c1ccc(CCl)cc1

Molecular Processing

Molecular formula
C8H7ClO2
Molecular weight
170.59
Exact mass
170.0135
XLogP
2.12
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
42.96

Supplementary Information

No supplementary data available

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