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Home Sulfos 1-(Mesitylsulfonyl)-3-nitro-1H-1,2,4-triazole

1-(Mesitylsulfonyl)-3-nitro-1H-1,2,4-triazole

CAS No.:
74257-00-4
Catalog Number:
AG003D3G
Molecular Formula:
C11H12N4O4S
Molecular Weight:
296.3024
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$48
- +
5g
98%
In Stock USA
United States
$62
- +
25g
98%
In Stock USA
United States
$187
- +
100g
98%
In Stock USA
United States
$612
- +
250g
98%
In Stock USA
United States
$1455
- +
Product Description
Catalog Number:
AG003D3G
Chemical Name:
1-(Mesitylsulfonyl)-3-nitro-1H-1,2,4-triazole
CAS Number:
74257-00-4
Molecular Formula:
C11H12N4O4S
Molecular Weight:
296.3024
MDL Number:
MFCD09751282
IUPAC Name:
3-nitro-1-(2,4,6-trimethylphenyl)sulfonyl-1,2,4-triazole
InChI:
InChI=1S/C11H12N4O4S/c1-7-4-8(2)10(9(3)5-7)20(18,19)14-6-12-11(13-14)15(16)17/h4-6H,1-3H3
InChI Key:
SFYDWLYPIXHPML-UHFFFAOYSA-N
SMILES:
Cc1cc(C)cc(c1S(=O)(=O)n1cnc(n1)[N+](=O)[O-])C
Properties
Complexity:
460  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.058g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.301g/mol
Monoisotopic Mass:
296.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
2'-Azido RNA, a versatile tool for chemical biology: synthesis, X-ray structure, siRNA applications, click labeling. ACS chemical biology 20120316
Chemical synthesis of site-specifically 2'-azido-modified RNA and potential applications for bioconjugation and RNA interference. Chembiochem : a European journal of chemical biology 20110103
Exploration of the one-bead one-compound methodology for the design of prolyl oligopeptidase substrates. PloS one 20090101
Properties