Nombre: 2-amino-3-(2,6-dichloro-phenyl)-propionic acid methyl ester hydrochloride salt
SMILES:
COC(=O)C(N)Cc1c(Cl)cccc1Cl.ClMolecular Processing
Molecular formula
C10H12Cl3NO2
Molecular weight
284.57
Exact mass
282.9934
XLogP
2.46
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.3
Molar refractivity
67.41
Supplementary Information
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