Cas no 24022-76-2 (9,11,13-Octadecatrienoicacid, (9Z,11Z,13E)-)
24022-76-2 structure
Product Name:9,11,13-Octadecatrienoicacid, (9Z,11Z,13E)-
CAS No:24022-76-2
MF:C18H30O2
MW:278.429605960846
CID:240367
Update Time:2024-02-29
9,11,13-Octadecatrienoicacid, (9Z,11Z,13E)- Chemical and Physical Properties
Names and Identifiers
-
- 9,11,13-Octadecatrienoicacid, (9Z,11Z,13E)-
- 9,11,13-Octadecatrienoicacid, (E,Z,Z)- (8CI)
- α-eleostearic acid
- CUXYLFPMQMFGPL-UICLQWDOSA-N
- 9,11,13-Octadecatrienoic acid, (9Z,11Z,13E)-
-
- Inchi： 1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h5-10H,2-4,11-17H2,1H3,(H,19,20)/b6-5+,8-7-,10-9-
- InChI Key： CUXYLFPMQMFGPL-UICLQWDOSA-N
- SMILES： C(O)(=O)CCCCCCC/C=C\C=C/C=C/CCCC
Computed Properties
- Exact Mass: 278.2247
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 13
- Complexity: 301
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 3
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: nothing
Experimental Properties
- PSA: 37.3
9,11,13-Octadecatrienoicacid, (9Z,11Z,13E)- Related Literature
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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Somenath Panda,Kaushik Kundu,Anusha Basaiahgari,Sanjib Senapati,Ramesh L. Gardas New J. Chem., 2018,42, 7105-7118
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Mei Zhang,Jingjing Guo,Tingting Liu,Zhanyu He,Majeed Irfan,Zujin Zhao,Zhuo Zeng J. Mater. Chem. C, 2020,8, 14919-14924
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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