名称: (2E)-4-[methyl(1-methylethyl)amino]but-2-enoic acid hydrochloride
SMILES:
CC(C)N(C)C/C=C/C(=O)O.ClMolecular Processing
Molecular formula
C8H16ClNO2
Molecular weight
193.67
Exact mass
193.087
XLogP
1.39
TPSA
40.54
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.625
Molar refractivity
51.79
Supplementary Information
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