| CAS Number | 96855-38-8 |
| Catalog Number | AG01DIQC(AGN-PC-0W6HZN) |
| Chemical Name | (R)-2-Bromo-1-(4-Bromophenyl)Ethanol |
| IUPAC Name | (1R)-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/t8-/m0/s1 |
| InChI Key | ZOCCHBFOKYCUST-QMMMGPOBSA-N |
| MDL Number | MFCD24346382 |
| Molecular Formula | C8H8Br2O |
| Molecular Weight | 279.9565 |
| SMILES | BrC[C@H](O)C1=CC=C(C=C1)Br |
| Synonyms | 96855-38-8,
(R)-2-Bromo-1-(4-bromophenyl)ethanol,
(1R)-2-bromo-1-(4-bromophenyl)ethan-1-ol,
ZINC34486716,
AKOS021321212,
(R)-1-(4-Bromophenyl)-2-bromoethanol,
AS-62744,
(r)-2-bromo-1-(4'-bromophenyl) ethanol,
2-bromo-1-(4-bromophenyl)ethanol,
CID11334980,
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| Complexity | 111 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.89214g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 279.96g/mol |
| Monoisotopic Mass | 277.89419g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
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Certificate of Analysis
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