SMILES:
C=CCC(N)CC=CMolecular Processing
Molecular formula
C7H13N
Molecular weight
111.19
Exact mass
111.1048
XLogP
1.47
TPSA
26.02
H-bond donors
1
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
0.429
Molar refractivity
37.6
Supplementary Information
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