Cas no 3626-69-5 (piperidine, 1-(1-oxo-2-butenyl)-)
3626-69-5 structure
Product Name:piperidine, 1-(1-oxo-2-butenyl)-
piperidine, 1-(1-oxo-2-butenyl)- Chemical and Physical Properties
Names and Identifiers
-
- piperidine, 1-(1-oxo-2-butenyl)-
- 1-piperidin-1-ylbut-2-en-1-one
- 1-(1-Oxobut-2-enyl)piperidine
- SCHEMBL10177866
- N-Crotonylpiperidine
- 50838-22-7
- 3626-69-5
- Piperidine, 1-crotonoyl-
- Piperidine,1-(1-oxo-2-butenyl)-,(E)
- crotonic acid piperidide
- EINECS 222-841-4
- 1-[(2E)-2-Butenoyl]piperidine #
- Piperidine, 1-(1-oxo-2-butenyl)-, (E)-
-
- Inchi： 1S/C9H15NO/c1-2-6-9(11)10-7-4-3-5-8-10/h2,6H,3-5,7-8H2,1H3/b6-2+
- InChI Key： DEHSTVNSEJEWPR-QHHAFSJGSA-N
- SMILES： O=C(/C=C/C)N1CCCCC1
Computed Properties
- Exact Mass: 153.11500
- Monoisotopic Mass: 153.115364
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 157
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.5
- Topological Polar Surface Area: 20.3
Experimental Properties
- Density: 0.986
- Boiling Point: 288.5°C at 760 mmHg
- Flash Point: 130.5°C
- Refractive Index: 1.492
- PSA: 20.31000
- LogP: 1.51290
piperidine, 1-(1-oxo-2-butenyl)- Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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