Nom: Hept-4-enal
SMILES:
CCC=CCCC=OMolecular Processing
Molecular formula
C7H12O
Molecular weight
112.17
Exact mass
112.0888
XLogP
1.93
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
8
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
0.571
Molar refractivity
34.73
Supplementary Information
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