Cas no 89927-33-3 (2(3H)-Furanone, dihydro-5-(3-oxobutyl)-)
89927-33-3 structure
Product Name:2(3H)-Furanone, dihydro-5-(3-oxobutyl)-
CAS No:89927-33-3
MF:C8H12O3
MW:156.179082870483
CID:585223
PubChem ID:13215722
Update Time:2025-04-19
2(3H)-Furanone, dihydro-5-(3-oxobutyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2(3H)-Furanone, dihydro-5-(3-oxobutyl)-
- 5-(3-oxobutyl)oxolan-2-one
- 7-oxo-4-octanolide
- DTXSID10528866
- SCHEMBL3621337
- 89927-33-3
-
- Inchi： 1S/C8H12O3/c1-6(9)2-3-7-4-5-8(10)11-7/h7H,2-5H2,1H3
- InChI Key： JJSQOYCRHZPDHY-UHFFFAOYSA-N
- SMILES： O1C(CCC1CCC(C)=O)=O
Computed Properties
- Exact Mass: 156.078644241g/mol
- Monoisotopic Mass: 156.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 174
- 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: 0.3
- Topological Polar Surface Area: 43.4?2
2(3H)-Furanone, dihydro-5-(3-oxobutyl)- Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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