Cas no 111047-36-0 (9,11-Tetradecadienoic acid, (9Z,11E)-)
111047-36-0 structure
Product Name:9,11-Tetradecadienoic acid, (9Z,11E)-
CAS No:111047-36-0
MF:C14H24O2
MW:224.339164733887
CID:1196232
PubChem ID:53649822
Update Time:2025-04-20
9,11-Tetradecadienoic acid, (9Z,11E)- Chemical and Physical Properties
Names and Identifiers
-
- 9,11-Tetradecadienoic acid, (9Z,11E)-
- tetradeca-9,11-dienoic acid
- DTXSID70705671
- 111047-36-0
-
- Inchi： 1S/C14H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h3-6H,2,7-13H2,1H3,(H,15,16)
- InChI Key： ALWJDQAPPAITSW-UHFFFAOYSA-N
- SMILES： OC(CCCCCCCC=CC=CCC)=O
Computed Properties
- Exact Mass: 224.17772
- Monoisotopic Mass: 224.177630004g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 10
- Complexity: 217
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 2
- XLogP3: 4.6
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
9,11-Tetradecadienoic acid, (9Z,11E)- Related Literature
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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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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