Cas no 72505-71-6 (2,6,10,14,18,22,26,30,34,38-Tetracontadecaenoicacid, 3,7,11,15,19,23,27,31,35,39-decamethyl-, ethyl ester)
72505-71-6 structure
Product Name:2,6,10,14,18,22,26,30,34,38-Tetracontadecaenoicacid, 3,7,11,15,19,23,27,31,35,39-decamethyl-, ethyl ester
CAS No:72505-71-6
MF:C52H84O2
MW:741.222176551819
CID:574355
Update Time:2025-04-19
2,6,10,14,18,22,26,30,34,38-Tetracontadecaenoicacid, 3,7,11,15,19,23,27,31,35,39-decamethyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2,6,10,14,18,22,26,30,34,38-Tetracontadecaenoicacid, 3,7,11,15,19,23,27,31,35,39-decamethyl-, ethyl ester
- decaprenoic ethyl ester
- ethyl (2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenoate
-
- Inchi： 1S/C52H84O2/c1-13-54-52(53)41-51(12)40-22-39-50(11)38-21-37-49(10)36-20-35-48(9)34-19-33-47(8)32-18-31-46(7)30-17-29-45(6)28-16-27-44(5)26-15-25-43(4)24-14-23-42(2)3/h23,25,27,29,31,33,35,37,39,41H,13-22,24,26,28,30,32,34,36,38,40H2,1-12H3/b43-25+,44-27+,45-29+,46-31+,47-33+,48-35+,49-37+,50-39+,51-41+
- InChI Key： XDGDODKRYSYPTQ-NUDDVCMYSA-N
- SMILES： O(CC)C(/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C)=O
Computed Properties
- Exact Mass: 740.64752
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 54
- Rotatable Bond Count: 30
- Complexity: 1370
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 9
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 18.6
Experimental Properties
- PSA: 26.3
2,6,10,14,18,22,26,30,34,38-Tetracontadecaenoicacid, 3,7,11,15,19,23,27,31,35,39-decamethyl-, ethyl ester Related Literature
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
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
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
72505-71-6 (2,6,10,14,18,22,26,30,34,38-Tetracontadecaenoicacid, 3,7,11,15,19,23,27,31,35,39-decamethyl-, ethyl ester) Related Products
- 16409-44-2(2,6-Octadien-1-ol,3,7-dimethyl-, 1-acetate)
- 7367-88-6(Ethyl 2-(E)-Decenoate)
- 1903-23-7(ethyl 2-cycloheptylideneacetate)
- 7367-82-0(trans-2-Octenoic acid ethyl ester)
- 1552-92-7(2-Cyclohexylidene-acetic Acid Ethyl Ester)
- 141-12-8(Neryl acetate)
- 10485-70-8(2,6,10-Dodecatrienoicacid, 3,7,11-trimethyl-, methyl ester)
- 1903-22-6(Ethyl 2-cyclopentylideneacetate)
- 27741-65-7(Ethyl 2-cyclobutylideneacetate)
- 15677-00-6(Ethyl-3-methyl-2-hexenoate)
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