Name: 4,5-dimethyl-4,5-dihydro-6H-cyclopenta[b]thiophen-6-one
SMILES:
CC1C(=O)c2sccc2C1CMolecular Processing
Molecular formula
C9H10OS
Molecular weight
166.24
Exact mass
166.0452
XLogP
2.68
TPSA
17.07
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
46.23
Supplementary Information
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