| CAS Number | 87762-20-7 |
| Catalog Number | AG004IDU(AGN-PC-0NJG1V) |
| Chemical Name | 2-((2-Bromophenyl)amino)ethanol |
| IUPAC Name | 2-(2-bromoanilino)ethanol |
| InChI | InChI=1S/C8H10BrNO/c9-7-3-1-2-4-8(7)10-5-6-11/h1-4,10-11H,5-6H2 |
| InChI Key | GFAZPFCJTBVZLC-UHFFFAOYSA-N |
| MDL Number | MFCD11153106 |
| Molecular Formula | C8H10BrNO |
| Molecular Weight | 216.0751 |
| SMILES | OCCNC1=C(Br)C=CC=C1 |
| Synonyms | 2-(2-Bromo-phenylamino)-ethanol,
87762-20-7,
2-((2-Bromophenyl)amino)ethanol,
Ethanol, 2-[(2-bromophenyl)amino]-,
2-(2-Bromoanilino)ethanol,
2-(2-bromophenylamino)ethanol,
SCHEMBL5962621,
2-(2-Bromoanilino)ethan-1-ol,
CTK3C1938,
DTXSID90502922,
ZINC20051671,
2-[(2-Bromophenyl)amino]ethan-1-ol,
AKOS000253943,
AM101450,
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| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.078g/mol |
| Monoisotopic Mass | 214.995g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
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