| CAS Number | 1461706-69-3 |
| Catalog Number | AG01A6FB |
| Chemical Name | 2-amino-1-(4-bromophenyl)-2-methylpropan-1-ol hydrochloride |
| IUPAC Name | 2-amino-1-(4-bromophenyl)-2-methylpropan-1-ol;hydrochloride |
| InChI | InChI=1S/C10H14BrNO.ClH/c1-10(2,12)9(13)7-3-5-8(11)6-4-7;/h3-6,9,13H,12H2,1-2H3;1H |
| InChI Key | QULFCVUQCZCGAN-UHFFFAOYSA-N |
| MDL Number | MFCD25371809 |
| Molecular Formula | C10H15BrClNO |
| Molecular Weight | 280.5892 |
| SMILES | Cl.CC(C(C1=CC=C(Br)C=C1)O)(N)C |
| Synonyms | 2-amino-1-(4-bromophenyl)-2-methylpropan-1-ol hydrochloride,
1461706-69-3,
NE29689,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.003g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.59g/mol |
| Monoisotopic Mass | 279.003g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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