이름: 4-chlorobutyl acetate
SMILES:
CC(=O)OCCCCClMolecular Processing
Molecular formula
C6H11ClO2
Molecular weight
150.61
Exact mass
150.0448
XLogP
1.57
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
9
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
0.833
Molar refractivity
36.59
Supplementary Information
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