| CAS Number | 628337-00-8 |
| Catalog Number | AG00IMEI(AGN-PC-0IKKHB) |
| Chemical Name | 9H-Carbazole, 3-bromo-9-octyl- |
| IUPAC Name | 3-bromo-9-octylcarbazole |
| InChI | InChI=1S/C20H24BrN/c1-2-3-4-5-6-9-14-22-19-11-8-7-10-17(19)18-15-16(21)12-13-20(18)22/h7-8,10-13,15H,2-6,9,14H2,1H3 |
| InChI Key | OQZRYECWBHQQAB-UHFFFAOYSA-N |
| MDL Number | MFCD31618112 |
| Molecular Formula | C20H24BrN |
| Molecular Weight | 358.3153 |
| SMILES | CCCCCCCCN1C2=C(C3=C1C=CC=C3)C=C(Br)C=C2 |
| Synonyms | 3-Bromo-9-octyl-9H-carbazole,
3-Bromo-9-n-octyl-9H-carbazole,
628337-00-8,
3-bromo-9-octylcarbazole,
SCHEMBL5998331,
OQZRYECWBHQQAB-UHFFFAOYSA-N,
B5610,
|
| Complexity | 332 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 357.109g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 358.323g/mol |
| Monoisotopic Mass | 357.109g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 4.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 7.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number