Name: Nitrobutane
SMILES:
CCCC[N+](=O)[O-]Molecular Processing
Molecular formula
C4H9NO2
Molecular weight
103.12
Exact mass
103.0633
XLogP
1.06
TPSA
43.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
1
Molar refractivity
26.77
Supplementary Information
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