Cas no 536-37-8 (Decanoic acid,2-hexyl-, sodium salt (1:1))
536-37-8 structure
Product Name:Decanoic acid,2-hexyl-, sodium salt (1:1)
CAS No:536-37-8
MF:C16H31NaO2
MW:278.405916452408
CID:370033
PubChem ID:23663631
Update Time:2025-04-19
Decanoic acid,2-hexyl-, sodium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Decanoic acid,2-hexyl-, sodium salt (1:1)
- sodium 2-hexyldecanoate
- 2-Hexyldecanoic acid sodium salt
- EINECS 208-629-4
- UNII-65104G179D
- DEVARICIN
- SODIUM .ALPHA.-HEXYLDECANOATE
- Q27263810
- 536-37-8
- (+/-)-SODIUM 2-HEXYLDECANOATE
- 65104G179D
- NS00079915
- DTXSID20968370
- sodium;2-hexyldecanoate
- DECANOIC ACID, 2-HEXYL-, SODIUM SALT (1:1)
- 2-HEXYLDECANOIC ACID SODIUM SALT [MI]
- SCHEMBL690000
-
- Inchi： 1S/C16H32O2.Na/c1-3-5-7-9-10-12-14-15(16(17)18)13-11-8-6-4-2;/h15H,3-14H2,1-2H3,(H,17,18);/q;+1/p-1
- InChI Key： PJBYSIMNLVXLRD-UHFFFAOYSA-M
- SMILES： [Na+].[O-]C(C(CCCCCC)CCCCCCCC)=O
Computed Properties
- Exact Mass: 278.22233
- Monoisotopic Mass: 278.222175
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 13
- Complexity: 195
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.1
Experimental Properties
- PSA: 40.13
Decanoic acid,2-hexyl-, sodium salt (1:1) Related Literature
-
Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
-
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
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
536-37-8 (Decanoic acid,2-hexyl-, sodium salt (1:1)) Related Products
- 610-09-3(cis-1,2-Cyclohexanedicarboxylic acid)
- 97-61-0(2-Methyl-pentanoic Acid)
- 1703-58-8(1,2,3,4-Butanetetracarboxylic acid)
- 1188-02-9(2-Methylheptanoic acid)
- 1460-16-8(Cycloheptanecarboxylic acid)
- 498-21-5(Methylsuccinic acid)
- 681-57-2(2,2-Dimethylglutaric acid)
- 619-82-9(trans-cyclohexane-1,4-dicarboxylic acid)
- 99-66-1(Valproic acid)
- 1076-97-7(1,4-Cyclohexanedicarboxylic Acid)
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