Name: benzenesulfonylisocyanate
SMILES:
O=C=NS(=O)(=O)c1ccccc1Molecular Processing
Molecular formula
C7H5NO3S
Molecular weight
183.19
Exact mass
182.999
XLogP
0.71
TPSA
63.57
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
41.75
Supplementary Information
Details werden geladen…
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