Nombre: 4′-Methyl-5-nitro-biphenyl-3-carboxylic acid methyl ester
SMILES:
COC(=O)c1cc(-c2ccc(C)cc2)cc([N+](=O)[O-])c1Molecular Processing
Molecular formula
C15H13NO4
Molecular weight
271.27
Exact mass
271.0845
XLogP
3.36
TPSA
69.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
74.61
Supplementary Information
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