Nom: 2-(2,3-epoxypropoxy)-4-methyl-6-nitroaniline
SMILES:
Cc1cc(OCC2CO2)c(N)c([N+](=O)[O-])c1Molecular Processing
Molecular formula
C10H12N2O4
Molecular weight
224.22
Exact mass
224.0797
XLogP
1.26
TPSA
90.92
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
57.48
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→