الاسم: 3-Chloropentane-2,4-dione
SMILES:
CC(=O)C(Cl)C(C)=OMolecular Processing
Molecular formula
C5H7ClO2
Molecular weight
134.56
Exact mass
134.0135
XLogP
0.77
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
31
Supplementary Information
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