이름: 2-amino-1-(thiophen-3yl)ethanone hydrochloride
SMILES:
Cl.NCC(=O)c1ccsc1Molecular Processing
Molecular formula
C6H8ClNOS
Molecular weight
177.66
Exact mass
177.0015
XLogP
1.31
TPSA
43.09
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.167
Molar refractivity
44.95
Supplementary Information
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