Cas no 651321-57-2 (Piperidine, 2-(1E)-1-propenyl-, (2R)-)
651321-57-2 structure
Product Name:Piperidine, 2-(1E)-1-propenyl-, (2R)-
CAS No:651321-57-2
MF:C8H15N
MW:125.211402177811
CID:405773
PubChem ID:11344021
Update Time:2025-04-19
Piperidine, 2-(1E)-1-propenyl-, (2R)- Chemical and Physical Properties
Names and Identifiers
-
- Piperidine, 2-(1E)-1-propenyl-, (2R)-
- Piperidine, 2-(1E)-1-propenyl-, (2R)- (9CI)
- Piperidine, 2-(1E)-1-propen-1-yl-, (2R)-
- 70W0597QV9
- .BETA.-CONICEINE, (E,R,-)-
- beta-Coniceine, (E,R,-)-
- beta-Coniceine, (E,-)-
- 651321-57-2
- .BETA.-CONICEINE, (E,-)-
- Q27265898
- UNII-70W0597QV9
- (E,-)-beta-coniceine
-
- Inchi： 1S/C8H15N/c1-2-5-8-6-3-4-7-9-8/h2,5,8-9H,3-4,6-7H2,1H3/b5-2+/t8-/m0/s1
- InChI Key： VSTUPIHCUMAUGE-NCJLJLRUSA-N
- SMILES： N1CCCC[C@@H]1/C=C/C
Computed Properties
- Exact Mass: 125.12055
- Monoisotopic Mass: 125.120449483g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 96.7
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 12?2
Experimental Properties
- PSA: 12.03
Piperidine, 2-(1E)-1-propenyl-, (2R)- Related Literature
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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