이름: α-methylthioacetophenone
SMILES:
CCC(=S)c1ccccc1Molecular Processing
Molecular formula
C9H10S
Molecular weight
150.25
Exact mass
150.0503
XLogP
2.81
TPSA
0
H-bond donors
0
H-bond acceptors
1
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
1
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
48.43
Supplementary Information
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