Home Sulfos Benzenesulfonamide, 2-(cyanomethyl)- (9CI)

Benzenesulfonamide, 2-(cyanomethyl)- (9CI)

CAS No.:
27350-01-2
Catalog Number:
AG00BL6Q
Molecular Formula:
C8H8N2O2S
Molecular Weight:
196.2263
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Product Description
Catalog Number:
AG00BL6Q
Chemical Name:
Benzenesulfonamide, 2-(cyanomethyl)- (9CI)
CAS Number:
27350-01-2
Molecular Formula:
C8H8N2O2S
Molecular Weight:
196.2263
MDL Number:
MFCD18292000
IUPAC Name:
2-(cyanomethyl)benzenesulfonamide
InChI:
InChI=1S/C8H8N2O2S/c9-6-5-7-3-1-2-4-8(7)13(10,11)12/h1-4H,5H2,(H2,10,11,12)
InChI Key:
QEVWMXVHIOULGX-UHFFFAOYSA-N
SMILES:
N#CCc1ccccc1S(=O)(=O)N
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.031g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.224g/mol
Monoisotopic Mass:
196.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties