| CAS Number | 1955541-61-3 |
| Catalog Number | AG01B65V |
| Chemical Name | 3-(3-Bromophenyl)morpholine hydrochloride |
| IUPAC Name | 3-(3-bromophenyl)morpholine;hydrochloride |
| InChI | InChI=1S/C10H12BrNO.ClH/c11-9-3-1-2-8(6-9)10-7-13-5-4-12-10;/h1-3,6,10,12H,4-5,7H2;1H |
| InChI Key | MTBVFNOCXSGYMK-UHFFFAOYSA-N |
| MDL Number | MFCD30181282 |
| Molecular Formula | C10H13BrClNO |
| Molecular Weight | 278.5733 |
| SMILES | BrC1=CC(C2NCCOC2)=CC=C1.[H]Cl |
| Synonyms | 3-(3-bromophenyl)morpholine hydrochloride,
1955541-61-3,
Z2526439817,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 276.987g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.574g/mol |
| Monoisotopic Mass | 276.987g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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