이름: 1-(4-methyl-pyridin-3-yl)-ethanone
SMILES:
CC(=O)c1cnccc1CMolecular Processing
Molecular formula
C8H9NO
Molecular weight
135.17
Exact mass
135.0684
XLogP
1.59
TPSA
29.96
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
38.98
Supplementary Information
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