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168971-53-7

168971-53-7 | Benzenesulfonamide, 2-cyano-N,N-dimethyl-

CAS No: 168971-53-7 Catalog No: AG001YEZ MDL No:MFCD03998843

Product Description

Catalog Number:
AG001YEZ
Chemical Name:
Benzenesulfonamide, 2-cyano-N,N-dimethyl-
CAS Number:
168971-53-7
Molecular Formula:
C9H10N2O2S
Molecular Weight:
210.2529
MDL Number:
MFCD03998843
IUPAC Name:
2-cyano-N,N-dimethylbenzenesulfonamide
InChI:
InChI=1S/C9H10N2O2S/c1-11(2)14(12,13)9-6-4-3-5-8(9)7-10/h3-6H,1-2H3
InChI Key:
HDKMCORZIWAQDA-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1S(=O)(=O)N(C)C

Properties

Complexity:
334  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.046g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.251g/mol
Monoisotopic Mass:
210.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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