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3323-26-0

3323-26-0 | 8-(4-nitrophenyl)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraene

CAS No: 3323-26-0 Catalog No: AG00I6H6 MDL No:MFCD00276341

Product Description

Catalog Number:
AG00I6H6
Chemical Name:
8-(4-nitrophenyl)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraene
CAS Number:
3323-26-0
Molecular Formula:
C13H9N3O2
Molecular Weight:
239.2295
MDL Number:
MFCD00276341
IUPAC Name:
2-(4-nitrophenyl)imidazo[1,2-a]pyridine
InChI:
InChI=1S/C13H9N3O2/c17-16(18)11-6-4-10(5-7-11)12-9-15-8-2-1-3-13(15)14-12/h1-9H
InChI Key:
SNBCSKCONKUZBA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)c1nc2n(c1)cccc2

Properties

Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.069g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.234g/mol
Monoisotopic Mass:
239.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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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