Cas no 62266-67-5 (3-Cyclohexene-1-carboxylic acid, dodecyl ester)
62266-67-5 structure
Product Name:3-Cyclohexene-1-carboxylic acid, dodecyl ester
CAS No:62266-67-5
MF:C19H34O2
MW:294.472066402435
CID:451799
PubChem ID:71388120
Update Time:2025-04-19
3-Cyclohexene-1-carboxylic acid, dodecyl ester Chemical and Physical Properties
Names and Identifiers
-
- 3-Cyclohexene-1-carboxylic acid, dodecyl ester
- dodecyl cyclohex-3-ene-1-carboxylate
- SCHEMBL22036450
- 62266-67-5
- DTXSID50810196
-
- Inchi： 1S/C19H34O2/c1-2-3-4-5-6-7-8-9-10-14-17-21-19(20)18-15-12-11-13-16-18/h11-12,18H,2-10,13-17H2,1H3
- InChI Key： UERPJYGBBJLVPP-UHFFFAOYSA-N
- SMILES： O(CCCCCCCCCCCC)C(C1CC=CCC1)=O
Computed Properties
- Exact Mass: 294.25602
- Monoisotopic Mass: 294.255880323g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 13
- Complexity: 283
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 7.2
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
3-Cyclohexene-1-carboxylic acid, dodecyl ester Related Literature
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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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
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
62266-67-5 (3-Cyclohexene-1-carboxylic acid, dodecyl ester) Related Products
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- 85-43-8(1,3,3a,4,7,7a-hexahydro-2-benzofuran-1,3-dione)
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- 21622-01-5(Ethyl 3-cyclopentene-1-carboxylate)
- 5048-50-0(Diethyl trans-4-Cyclohexene-1,2-dicarboxylate)
- 5333-84-6(3-Methyl-4-cyclohexene-1,2-dicarboxylic Anhydride)
- 935-79-5((3aR,7aS)-1,3,3a,4,7,7a-hexahydro-2-benzofuran-1,3-dione)
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