| CAS Number | 58777-84-7 |
| Catalog Number | AG01B2M0(AGN-PC-0SQIWW) |
| Chemical Name | 2-bromo-1-(4-bromophenyl)ethanol |
| IUPAC Name | 2-bromo-1-(4-bromophenyl)ethanol |
| InChI | InChI=1S/C8H8Br2O/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4,8,11H,5H2 |
| InChI Key | ZOCCHBFOKYCUST-UHFFFAOYSA-N |
| MDL Number | MFCD13186687 |
| Molecular Formula | C8H8Br2O |
| Molecular Weight | 279.9565 |
| SMILES | OC(C1=CC=C(Br)C=C1)CBr |
| Synonyms | 2-bromo-1-(4-bromophenyl)ethanol,
58777-84-7,
2-bromo-1-(4-bromophenyl)ethan-1-ol,
(R)-2-Bromo-1-(4-bromophenyl)ethanol,
96855-38-8,
SCHEMBL918222,
1-(4-Bromophenyl)-2-bromoethanol,
2,4'-dibromo-1-phenylethan-1-ol,
AKOS017560430,
Benzenemethanol, 4-bromo-alpha-(bromomethyl)-,
CID10945819,
|
| Complexity | 111 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.892g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 279.959g/mol |
| Monoisotopic Mass | 277.894g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number