Name: 5-cyano-2-methoxybenzensulfonyl chloride
SMILES:
COc1ccc(C#N)cc1S(=O)(=O)ClMolecular Processing
Molecular formula
C8H6ClNO3S
Molecular weight
231.66
Exact mass
230.9757
XLogP
1.49
TPSA
67.16
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
50.75
Supplementary Information
Details werden geladen…
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