Nom: ethyl 3-(aminomethyl)-2-methoxybenzoate hydrochloride
SMILES:
CCOC(=O)c1cccc(CN)c1OC.ClMolecular Processing
Molecular formula
C11H16ClNO3
Molecular weight
245.71
Exact mass
245.0819
XLogP
1.75
TPSA
61.55
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.364
Molar refractivity
64.09
Supplementary Information
Récupération des détails…
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