이름: octyn-1-ol
SMILES:
CCCCCCC#COMolecular Processing
Molecular formula
C8H14O
Molecular weight
126.2
Exact mass
126.1045
XLogP
2.29
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
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
1
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
38.47
Supplementary Information
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