Cas no 166520-98-5 (Dodecanoic acid, 9-decenyl ester)
166520-98-5 structure
Product Name:Dodecanoic acid, 9-decenyl ester
CAS No:166520-98-5
MF:C22H42O2
MW:338.567687511444
CID:2781199
PubChem ID:543455
Update Time:2025-04-21
Dodecanoic acid, 9-decenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Dodecanoic acid, 9-decenyl ester
- DTXCID00288664
- Dodecanoic acid, 9-decen-1-yl ester
- SCHEMBL8661496
- 9-Decenyl laurate #
- 166520-98-5
- DTXSID10337576
- RLZIIYYLBOKIHP-UHFFFAOYSA-N
-
- Inchi： 1S/C22H42O2/c1-3-5-7-9-11-13-14-16-18-20-22(23)24-21-19-17-15-12-10-8-6-4-2/h4H,2-3,5-21H2,1H3
- InChI Key： RLZIIYYLBOKIHP-UHFFFAOYSA-N
- SMILES： O(C(CCCCCCCCCCC)=O)CCCCCCCCC=C
Computed Properties
- Exact Mass: 338.318480578Da
- Monoisotopic Mass: 338.318480578Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 24
- Rotatable Bond Count: 20
- Complexity: 273
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 9.3
- Topological Polar Surface Area: 26.3?2
Dodecanoic acid, 9-decenyl ester Related Literature
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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