Cas no 37749-91-0 (2-Butanone, 1-(tetrahydro-2H-pyran-2-yl)-)
37749-91-0 structure
Product Name:2-Butanone, 1-(tetrahydro-2H-pyran-2-yl)-
CAS No:37749-91-0
MF:C9H16O2
MW:156.222143173218
CID:1486029
PubChem ID:12328996
Update Time:2025-04-21
2-Butanone, 1-(tetrahydro-2H-pyran-2-yl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Butanone, 1-(tetrahydro-2H-pyran-2-yl)-
- 1-(oxan-2-yl)butan-2-one
- DTXSID40490188
- 37749-91-0
-
- Inchi： 1S/C9H16O2/c1-2-8(10)7-9-5-3-4-6-11-9/h9H,2-7H2,1H3
- InChI Key： FUCKVCDYVWRPGH-UHFFFAOYSA-N
- SMILES： O1CCCCC1CC(CC)=O
Computed Properties
- Exact Mass: 156.11508
- Monoisotopic Mass: 156.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 132
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.1
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2-Butanone, 1-(tetrahydro-2H-pyran-2-yl)- Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
37749-91-0 (2-Butanone, 1-(tetrahydro-2H-pyran-2-yl)-) Related Products
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