| CAS Number | 1177327-68-2 |
| Catalog Number | AG00HE5K(AGN-PC-0WCN07) |
| Chemical Name | 2-(4-Bromo-2-thienyl)piperidine, HCl |
| IUPAC Name | 2-(4-bromothiophen-2-yl)piperidine;hydrochloride |
| InChI | InChI=1S/C9H12BrNS.ClH/c10-7-5-9(12-6-7)8-3-1-2-4-11-8;/h5-6,8,11H,1-4H2;1H |
| InChI Key | QUNXIIPMDKSEAN-UHFFFAOYSA-N |
| MDL Number | MFCD08277195 |
| Molecular Formula | C9H13BrClNS |
| Molecular Weight | 282.6282 |
| SMILES | Brc1csc(c1)C1CCCCN1.Cl |
| Synonyms | 1177327-68-2,
2-(4-bromothiophen-2-yl)piperidine hydrochloride,
2-(4-Bromo-2-thienyl)piperidine, HCl,
ZX-BK002206,
KM4693,
MFCD08277195,
AKOS005144036,
C6A-0357,
2-(4-Bromothiophen-2-yl)piperidine (HCl),
2-(4-BROMO-2-THIENYL)PIPERIDINE HYDROCHLORIDE,
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| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 280.964g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 282.624g/mol |
| Monoisotopic Mass | 280.964g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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