Nombre: 1-nitro-2-(3,3,4,4-tetramethylcyclopent-1-enyl)benzene
SMILES:
CC1(C)C=C(c2ccccc2[N+](=O)[O-])CC1(C)CMolecular Processing
Molecular formula
C15H19NO2
Molecular weight
245.32
Exact mass
245.1416
XLogP
4.43
TPSA
43.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
73.25
Supplementary Information
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