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Home > Other Building Blocks > 16111-01-6
16111-01-6 | 6,6'-Biquinoxaline, 2,2',3,3'-tetraphenyl-
CAS No: 16111-01-6 Catalog No: AG001S6F MDL No:
Product Description
Catalog Number:
AG001S6F
Chemical Name:
6,6'-Biquinoxaline, 2,2',3,3'-tetraphenyl-
CAS Number:
16111-01-6
Molecular Formula:
C40H26N4
Molecular Weight:
562.6612
IUPAC Name:
6-(2,3-diphenylquinoxalin-6-yl)-2,3-diphenylquinoxaline
InChI:
InChI=1S/C40H26N4/c1-5-13-27(14-6-1)37-39(29-17-9-3-10-18-29)43-35-25-31(21-23-33(35)41-37)32-22-24-34-36(26-32)44-40(30-19-11-4-12-20-30)38(42-34)28-15-7-2-8-16-28/h1-26H
InChI Key:
QESBRXIXJOBVGC-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1nc2cc(ccc2nc1c1ccccc1)c1ccc2c(c1)nc(c(n2)c1ccccc1)c1ccccc1
Properties
Complexity:
812
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
562.216g/mol
Formal Charge:
0
Heavy Atom Count:
44
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
562.676g/mol
Monoisotopic Mass:
562.216g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.8
Literature
| Title | Journal |
|---|---|
| 2,2,3,3'-Tetra-phenyl-7,7'-biquinoxaline. | Acta crystallographica. Section E, Structure reports online 20080101 |
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