| CAS Number | 946714-44-9 |
| Catalog Number | AG01EHDF |
| Chemical Name | 3-(4-Bromophenoxy)piperidine |
| IUPAC Name | 3-(4-bromophenoxy)piperidine |
| InChI | InChI=1S/C11H14BrNO/c12-9-3-5-10(6-4-9)14-11-2-1-7-13-8-11/h3-6,11,13H,1-2,7-8H2 |
| InChI Key | OWGPKBGDUAIXRS-UHFFFAOYSA-N |
| MDL Number | MFCD08687060 |
| Molecular Formula | C11H14BrNO |
| Molecular Weight | 256.1390 |
| SMILES | BrC1=CC=C(OC2CNCCC2)C=C1 |
| Synonyms | 3-(4-BROMOPHENOXY)PIPERIDINE,
946714-44-9,
DTXSID90647908,
AKOS005263866,
3-(4-bromo-phenoxy)-piperidine,
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| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.143g/mol |
| Monoisotopic Mass | 255.026g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number