이름: 2-tert-butyl-5-nitro-aniline
SMILES:
CC(C)(C)c1ccc([N+](=O)[O-])cc1NMolecular Processing
Molecular formula
C10H14N2O2
Molecular weight
194.23
Exact mass
194.1055
XLogP
2.47
TPSA
69.16
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
56.21
Supplementary Information
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