Name: 1D
SMILES:
Cc1ccc([N+](=O)[O-])c2c1CCC(C)O2Molecular Processing
Molecular formula
C11H13NO3
Molecular weight
207.23
Exact mass
207.0895
XLogP
2.62
TPSA
52.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
56.24
Supplementary Information
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Involved in 2 reactions→