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130879-54-8

130879-54-8 | 1-methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile

CAS No: 130879-54-8 Catalog No: AG01FONY MDL No:

Product Description

Catalog Number:
AG01FONY
Chemical Name:
1-methyl-2-oxo-5-phenyl-1,2-dihydro-3-pyridinecarbonitrile
CAS Number:
130879-54-8
IUPAC Name:
1-methyl-2-oxo-5-phenylpyridine-3-carbonitrile
InChI:
InChI=1S/C13H10N2O/c1-15-9-12(7-11(8-14)13(15)16)10-5-3-2-4-6-10/h2-7,9H,1H3
InChI Key:
QDJMBXOGLZMLJK-UHFFFAOYSA-N

Properties

Complexity:
405  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.079g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.236g/mol
Monoisotopic Mass:
210.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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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