COc1ccc([N+](=O)[O-])cc1CO
Name: 2-methoxy-5-nitrobenzylalcohol
SMILES: COc1ccc([N+](=O)[O-])cc1CO

Molecular Processing

Molecular formula
C8H9NO4
Molecular weight
183.16
Exact mass
183.0532
XLogP
1.1
TPSA
72.6
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
45.57

Supplementary Information

Details werden geladen…

An 11 Reaktionen beteiligt