名称: 2,5-dichloroindan-1-one
SMILES:
O=C1c2ccc(Cl)cc2CC1ClMolecular Processing
Molecular formula
C9H6Cl2O
Molecular weight
201.05
Exact mass
199.9796
XLogP
2.69
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
49.13
Supplementary Information
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