2-(4-Bromo-2-thienyl)piperidine hydrochloride - CAS 1177327-68-2
Catalog: |
BB061994 |
Product Name: |
2-(4-Bromo-2-thienyl)piperidine hydrochloride |
CAS: |
1177327-68-2 |
Synonyms: |
2-(4-Bromo-2-thienyl)piperidine, HCl; 2-(4-bromothiophen-2-yl)piperidine hydrochloride; 2-(4-bromothiophen-2-yl)piperidine; hydrochloride; 2-(4-Bromo-2-thienyl)piperidine,HCl |
IUPAC Name: | 2-(4-bromothiophen-2-yl)piperidinehydrochloride |
Molecular Weight: | 282.63 |
Molecular Formula: | C9H13BrClNS |
Canonical SMILES: | C1CCNC(C1)C2=CC(=CS2)Br.Cl |
InChI: | InChI=1S/C9H12BrNS.ClH/c10-7-5-9(12-6-7)8-3-1-2-4-11-8/h5-6,8,11H,1-4H21H |
InChI Key: | QUNXIIPMDKSEAN-UHFFFAOYSA-N |
Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 280.96406 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 280.96406 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 40.3Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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