Cas no 51193-77-2 (3-octenone,(Z)-3-octen-2-one)
3-octenone,(Z)-3-octen-2-one structure
Product Name:3-octenone,(Z)-3-octen-2-one
CAS No:51193-77-2
MF:C8H14O
MW:126.196162700653
CID:934956
PubChem ID:6429262
Update Time:2025-04-19
3-octenone,(Z)-3-octen-2-one Chemical and Physical Properties
Names and Identifiers
-
- 3-octenone,(Z)-3-octen-2-one
- (Z)-3-octen-2-one
- 3-octen-2-one, (3Z)-
- trans-3-Octen-2-one
- (3E)-3-Octen-2-one
- (E)-3-Octen-2-one
- FEMA 3416
- 51193-77-2
- (3Z)-3-octen-2-one
- DB-235068
- (Z)-3-Octen-2-on
- SCHEMBL5184171
- DTXSID201017543
- ZCFOBLITZWHNNC-SREVYHEPSA-N
-
- Inchi： 1S/C8H14O/c1-3-4-5-6-7-8(2)9/h6-7H,3-5H2,1-2H3/b7-6+
- InChI Key： ZCFOBLITZWHNNC-VOTSOKGWSA-N
- SMILES： CCCC/C=C/C(=O)C
Computed Properties
- Exact Mass: 126.10452
- Monoisotopic Mass: 126.104465066g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 103
- 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: 2.6
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- Density: 0.833
- Boiling Point: 180.4°C at 760 mmHg
- Flash Point: 67.1°C
- Refractive Index: 1.431
- PSA: 17.07
3-octenone,(Z)-3-octen-2-one Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
51193-77-2 (3-octenone,(Z)-3-octen-2-one) Related Products
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- 18402-82-9((E)-3-Octen-2-one)
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