COCCOc1ccc(N)c([N+](=O)[O-])c1
Name: 4-(2-methoxyethoxy)-2-nitroaniline
SMILES: COCCOc1ccc(N)c([N+](=O)[O-])c1

Molecular Processing

Molecular formula
C9H12N2O4
Molecular weight
212.2
Exact mass
212.0797
XLogP
1.2
TPSA
87.62
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
54.88

Supplementary Information

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