SMILES:
C#CCCCOMolecular Processing
Molecular formula
C5H8O
Molecular weight
84.12
Exact mass
84.0575
XLogP
0.39
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
6
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
0.6
Molar refractivity
25.15
Supplementary Information
No supplementary data available
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