Cas no 827029-48-1 (Dodecanoic acid, 3,7,11-trimethyl-2,6,10-dodecatrienyl ester)
827029-48-1 structure
Product Name:Dodecanoic acid, 3,7,11-trimethyl-2,6,10-dodecatrienyl ester
CAS No:827029-48-1
MF:C27H48O2
MW:404.668828964233
CID:686305
PubChem ID:71417775
Update Time:2025-04-19
Dodecanoic acid, 3,7,11-trimethyl-2,6,10-dodecatrienyl ester Chemical and Physical Properties
Names and Identifiers
-
- Dodecanoic acid, 3,7,11-trimethyl-2,6,10-dodecatrienyl ester
- 3,7,11-trimethyldodeca-2,6,10-trienyl dodecanoate
- 827029-48-1
- 3,7,11-TRIMETHYLDODECA-2,6,10-TRIEN-1-YL DODECANOATE
- farnesyl laurate
- DTXSID10837107
-
- Inchi： 1S/C27H48O2/c1-6-7-8-9-10-11-12-13-14-21-27(28)29-23-22-26(5)20-16-19-25(4)18-15-17-24(2)3/h17,19,22H,6-16,18,20-21,23H2,1-5H3
- InChI Key： APTQJZOTWYEACL-UHFFFAOYSA-N
- SMILES： O(CC=C(C)CCC=C(C)CC/C=C(\C)/C)C(CCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 404.365430770g/mol
- Monoisotopic Mass: 404.365430770g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 29
- Rotatable Bond Count: 19
- Complexity: 493
- 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: 10.5
- Topological Polar Surface Area: 26.3?2
Dodecanoic acid, 3,7,11-trimethyl-2,6,10-dodecatrienyl ester Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
827029-48-1 (Dodecanoic acid, 3,7,11-trimethyl-2,6,10-dodecatrienyl ester) Related Products
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- 51-77-4(Gefarnate)
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