이름: 1-chloro-3-octanol
SMILES:
CCCCCC(O)CCClMolecular Processing
Molecular formula
C8H17ClO
Molecular weight
164.68
Exact mass
164.0968
XLogP
2.56
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
1
Molar refractivity
45.49
Supplementary Information
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