이름: 4-chloromethylthiopyridine
SMILES:
ClCSc1ccncc1Molecular Processing
Molecular formula
C6H6ClNS
Molecular weight
159.64
Exact mass
158.9909
XLogP
2.37
TPSA
12.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
40.81
Supplementary Information
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