Benzonitrile, 4-[(methylamino)sulfonyl]-


Chemical Name: Benzonitrile, 4-[(methylamino)sulfonyl]-
CAS Number: 56236-82-9
Product Number: AG019MYJ(AGN-PC-0NKMDV)
Synonyms:
MDL No:
Molecular Formula: C8H8N2O2S
Molecular Weight: 196.2263

Identification/Properties


Computed Properties
Molecular Weight:
196.224g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
196.031g/mol
Monoisotopic Mass:
196.031g/mol
Topological Polar Surface Area:
78.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
301
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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