| CAS Number | 1238156-36-9 |
| Catalog Number | AG009WPK(AGN-PC-0WQUJZ) |
| Chemical Name | 1-Bromo-3,5-dihexylbenzene |
| IUPAC Name | 1-bromo-3,5-dihexylbenzene |
| InChI | InChI=1S/C18H29Br/c1-3-5-7-9-11-16-13-17(15-18(19)14-16)12-10-8-6-4-2/h13-15H,3-12H2,1-2H3 |
| InChI Key | FVTKYSBFHHVYJG-UHFFFAOYSA-N |
| MDL Number | MFCD28369417 |
| Molecular Formula | C18H29Br |
| Molecular Weight | 325.3269 |
| SMILES | CCCCCCC1=CC(=CC(=C1)Br)CCCCCC |
| Synonyms | 1-bromo-3,5-dihexylbenzene,
1238156-36-9,
SCHEMBL1353064,
FVTKYSBFHHVYJG-UHFFFAOYSA-N,
1-bromo-3,5-di(n-hexyl)benzene,
MFCD28369417,
ZINC115943534,
B4818,
|
| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 324.145g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 325.334g/mol |
| Monoisotopic Mass | 324.145g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 8.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number