Nom: N-(4-Methyl-5-ethyl-1,3-dioxolan-2-ylmethyl)-2-methoxyaniline
SMILES:
CCC1OC(CNc2ccccc2OC)OC1CMolecular Processing
Molecular formula
C14H21NO3
Molecular weight
251.33
Exact mass
251.1521
XLogP
2.65
TPSA
39.72
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
70.98
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→