Cas no 68779-88-4 (8-Dodecenoic acid, 11-hydroxy-, methyl ester, (E)-)
68779-88-4 structure
Product Name:8-Dodecenoic acid, 11-hydroxy-, methyl ester, (E)-
CAS No:68779-88-4
MF:C13H24O3
MW:228.327864646912
CID:392591
PubChem ID:542277
Update Time:2025-04-19
8-Dodecenoic acid, 11-hydroxy-, methyl ester, (E)- Chemical and Physical Properties
Names and Identifiers
-
- 8-Dodecenoic acid, 11-hydroxy-, methyl ester, (E)-
- methyl 11-hydroxydodec-8-enoate
- DTXSID70337375
- 68779-88-4
-
- Inchi： 1S/C13H24O3/c1-12(14)10-8-6-4-3-5-7-9-11-13(15)16-2/h6,8,12,14H,3-5,7,9-11H2,1-2H3
- InChI Key： DBQANRZQBIMWGK-UHFFFAOYSA-N
- SMILES： OC(C)CC=CCCCCCCC(=O)OC
Computed Properties
- Exact Mass: 228.17262
- Monoisotopic Mass: 228.17254462g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 10
- Complexity: 199
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 3
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
8-Dodecenoic acid, 11-hydroxy-, methyl ester, (E)- Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Jason Wan Lab Chip, 2020,20, 4528-4538
68779-88-4 (8-Dodecenoic acid, 11-hydroxy-, methyl ester, (E)-) Related Products
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