이름: alcohol
SMILES:
OCCNCC1CCC1Molecular Processing
Molecular formula
C7H15NO
Molecular weight
129.2
Exact mass
129.1154
XLogP
0.37
TPSA
32.26
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
9
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
1
Molar refractivity
37.3
Supplementary Information
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