Cas no 79771-18-9 (125302-00-3)
125302-00-3 structure
Product Name:125302-00-3
CAS No:79771-18-9
MF:C36H62Na2O4
MW:604.854633808136
CID:565362
PubChem ID:6441945
Update Time:2025-04-19
125302-00-3 Chemical and Physical Properties
Names and Identifiers
-
- 9,12-Octadecadienoic acid (Z,Z)-, dimer, diammonium salt
- disodium,(9Z,12Z)-octadeca-9,12-dienoate
- 9,12-Octadecadienoic acid (9Z,12Z)-, dimer, diammonium salt
- 9,12-Octadecadienoic acid (9Z,12Z)-, dimer, ammonium salt (1:2)
- 79771-18-9
- 125302-00-3
-
- Inchi： 1S/2C18H32O2.2Na/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;;/h2*6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);;/q;;2*+1/p-2/b2*7-6-,10-9-;;
- InChI Key： WIXVFZFEQMPERU-CGKDLMRESA-L
- SMILES： [Na+].[Na+].[O-]C(CCCCCCC/C=C\C/C=C\CCCCC)=O.[O-]C(CCCCCCC/C=C\C/C=C\CCCCC)=O
Computed Properties
- Exact Mass: 604.44435
- Monoisotopic Mass: 604.44435
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 42
- Rotatable Bond Count: 26
- Complexity: 261
- Covalently-Bonded Unit Count: 4
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 4
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 80.3
125302-00-3 Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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