이름: 2-aminobutyric acid methyl ester hydrochloride
SMILES:
CCC(N)C(=O)OC.ClMolecular Processing
Molecular formula
C5H12ClNO2
Molecular weight
153.61
Exact mass
153.0557
XLogP
0.32
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.8
Molar refractivity
37.53
Supplementary Information
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