| CAS Number | 1158227-56-5 |
| Catalog Number | AG00945S(AGN-PC-0WQUK5) |
| Chemical Name | 2-(4-Bromophenyl)triphenylene |
| IUPAC Name | 2-(4-bromophenyl)triphenylene |
| InChI | InChI=1S/C24H15Br/c25-18-12-9-16(10-13-18)17-11-14-23-21-7-2-1-5-19(21)20-6-3-4-8-22(20)24(23)15-17/h1-15H |
| InChI Key | FWESVNIHRVSDDV-UHFFFAOYSA-N |
| MDL Number | MFCD28975105 |
| Molecular Formula | C24H15Br |
| Molecular Weight | 383.2799 |
| SMILES | C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C=CC(=C4)C5=CC=C(C=C5)Br |
| Synonyms | 2-(4-bromophenyl)triphenylene,
1158227-56-5,
SCHEMBL3455249,
FWESVNIHRVSDDV-UHFFFAOYSA-N,
MFCD28975105,
AKOS026671305,
ZINC145202516,
1158277-56-5,
B4955,
|
| Complexity | 451 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 382.036g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 383.288g/mol |
| Monoisotopic Mass | 382.036g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 7.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number