| CAS Number | 1174006-47-3 |
| Catalog Number | AG008Y18 |
| Chemical Name | 9,9-bis[4-(pyrenyl)phenyl]-9H-fluorene |
| IUPAC Name | 1-[4-[9-(4-pyren-1-ylphenyl)fluoren-9-yl]phenyl]pyrene |
| InChI | InChI=1S/C57H34/c1-3-13-51-47(11-1)48-12-2-4-14-52(48)57(51,43-27-19-35(20-28-43)45-31-23-41-17-15-37-7-5-9-39-25-33-49(45)55(41)53(37)39)44-29-21-36(22-30-44)46-32-24-42-18-16-38-8-6-10-40-26-34-50(46)56(42)54(38)40/h1-34H |
| InChI Key | WHLKCPQPGTUZBU-UHFFFAOYSA-N |
| MDL Number | MFCD12022454 |
| Molecular Formula | C57H34 |
| Molecular Weight | 718.8799 |
| SMILES | c1ccc2c(c1)-c1ccccc1C2(c1ccc(cc1)-c1ccc2ccc3cccc4ccc1c2c34)c1ccc(cc1)-c1ccc2ccc3cccc4ccc1c2c34 |
| Synonyms | 1174006-47-3,
9,9-BIS[4-(PYRENYL)PHENYL]-9H-FLUORENE,
AKOS027253718,
9,9-Bis[4-(1-pyrenyl)phenyl]fluorene,
9,9-Bis[4-(1-pyrenyl)phenyl]-9H-fluorene,
1-[4-[9-(4-pyren-1-ylphenyl)fluoren-9-yl]phenyl]pyrene,
1,1'-((9H-Fluorene-9,9-diyl)bis(4,1-phenylene))dipyrene,
B4980,
1,1'-(9H-Fluoren-9-ylidenedi-4,1-phenylene)bispyrene,
|
| Complexity | 1300 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 718.266g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 57 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 718.899g/mol |
| Monoisotopic Mass | 718.266g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 16.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number