Cas no 16424-31-0 (Tetradecanoic acid,5-oxo-)
Tetradecanoic acid,5-oxo- structure
Product Name:Tetradecanoic acid,5-oxo-
CAS No:16424-31-0
MF:C14H26O3
MW:242.354444980621
CID:183701
PubChem ID:85410
Update Time:2025-04-19
Tetradecanoic acid,5-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Tetradecanoic acid,5-oxo-
- 5-oxomyristic acid
- 5-oxotetradecanoic acid
- Einecs 240-475-3
- 5-Ketomyristic acid
- BK78MM4X6P
- Q27274722
- DTXSID30167731
- Tetradecanoic acid, 5-oxo-
- NS00025367
- 16424-31-0
- UNII-BK78MM4X6P
-
- Inchi： 1S/C14H26O3/c1-2-3-4-5-6-7-8-10-13(15)11-9-12-14(16)17/h2-12H2,1H3,(H,16,17)
- InChI Key： KGKVVLCMDWQMOR-UHFFFAOYSA-N
- SMILES： O=C(CCCC(=O)O)CCCCCCCCC
Computed Properties
- Exact Mass: 242.18828
- Monoisotopic Mass: 242.18819469g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 12
- Complexity: 212
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4
- Topological Polar Surface Area: 54.4?2
Experimental Properties
- PSA: 54.37
Tetradecanoic acid,5-oxo- Related Literature
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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