200,000+ products from a single source!

sales@angenechem.com

Home > Carboxes > 10176-63-3

10176-63-3

10176-63-3 | 3-Pyridinecarbonitrile, 2-chloro-6-methyl-5-phenyl-

CAS No: 10176-63-3 Catalog No: AG0005FI MDL No:MFCD00231559

Product Description

Catalog Number:
AG0005FI
Chemical Name:
3-Pyridinecarbonitrile, 2-chloro-6-methyl-5-phenyl-
CAS Number:
10176-63-3
Molecular Formula:
C13H9ClN2
Molecular Weight:
228.6770
MDL Number:
MFCD00231559
IUPAC Name:
2-chloro-6-methyl-5-phenylpyridine-3-carbonitrile
InChI:
InChI=1S/C13H9ClN2/c1-9-12(10-5-3-2-4-6-10)7-11(8-15)13(14)16-9/h2-7H,1H3
InChI Key:
IKKNXDBSPNSUOA-UHFFFAOYSA-N
SMILES:
N#Cc1cc(c2ccccc2)c(nc1Cl)C

Properties

Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.045g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.679g/mol
Monoisotopic Mass:
228.045g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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

© 2019 Angene International Limited. All rights Reserved.