200,000+ products from a single source!

sales@angenechem.com

Home > Pyridines > 116850-57-8

116850-57-8

116850-57-8 | Pyridine, 4-[4-methyl-5-(methylsulfonyl)-4H-1,2,4-triazol-3-yl]-

CAS No: 116850-57-8 Catalog No: AG000DAU MDL No:MFCD16294198

Product Description

Catalog Number:
AG000DAU
Chemical Name:
Pyridine, 4-[4-methyl-5-(methylsulfonyl)-4H-1,2,4-triazol-3-yl]-
CAS Number:
116850-57-8
Molecular Formula:
C9H10N4O2S
Molecular Weight:
238.2663
MDL Number:
MFCD16294198
IUPAC Name:
4-(4-methyl-5-methylsulfonyl-1,2,4-triazol-3-yl)pyridine
InChI:
InChI=1S/C9H10N4O2S/c1-13-8(7-3-5-10-6-4-7)11-12-9(13)16(2,14)15/h3-6H,1-2H3
InChI Key:
WYLYCKVEMTYWML-UHFFFAOYSA-N
SMILES:
Cn1c(nnc1S(=O)(=O)C)c1ccncc1

Properties

Complexity:
334  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.052g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.265g/mol
Monoisotopic Mass:
238.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
86.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  

Related Products

© 2019 Angene International Limited. All rights Reserved.