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554425-48-8

554425-48-8 | 1-hydroxy-N,N-dimethyl-1H-1,2,3-benzotriazole-6-sulfonamide

CAS No: 554425-48-8 Catalog No: AG019I8H MDL No:MFCD03985185

Product Description

Catalog Number:
AG019I8H
Chemical Name:
1-hydroxy-N,N-dimethyl-1H-1,2,3-benzotriazole-6-sulfonamide
CAS Number:
554425-48-8
Molecular Formula:
C8H10N4O3S
Molecular Weight:
242.2550
MDL Number:
MFCD03985185
IUPAC Name:
3-hydroxy-N,N-dimethylbenzotriazole-5-sulfonamide
InChI:
InChI=1S/C8H10N4O3S/c1-11(2)16(14,15)6-3-4-7-8(5-6)12(13)10-9-7/h3-5,13H,1-2H3
InChI Key:
MMTNAHRIPAKUCD-UHFFFAOYSA-N
SMILES:
On1nnc2c1cc(cc2)S(=O)(=O)N(C)C

Properties

Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.047g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
242.253g/mol
Monoisotopic Mass:
242.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
96.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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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