CCCC(C(C(=O)OCC)O)N.Cl
CAS: 2228128-86-5
Nombre: ethyl 3-amino-2-hydroxyhexanoate;hydrochloride
SMILES: CCCC(C(C(=O)OCC)O)N.Cl

Molecular Processing

Molecular formula
C8H18ClNO3
Molecular weight
211.69
Exact mass
211.0975
XLogP
0.46
TPSA
72.55
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
13
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.875
Molar refractivity
52.77

Supplementary Information

InChIKey: IWPQZGJXTUNLSM-UHFFFAOYSA-N
Sinónimos
ethyl 3-amino-2-hydroxyhexanoate hydrochloride2228128-86-5SCHEMBL1666710IWPQZGJXTUNLSM-UHFFFAOYSA-NEN300-2212633-amino-2-hydroxy-hexanoic acid ethyl ester hydrochloride
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