Cas no 106140-57-2 (2,4-Pentadienoic acid, 3-ethyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)-,methyl ester, (Z,E)-)
106140-57-2 structure
Product Name:2,4-Pentadienoic acid, 3-ethyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)-,methyl ester, (Z,E)-
CAS No:106140-57-2
MF:C17H26O2
MW:262.387145519257
CID:1179897
Update Time:2024-08-05
2,4-Pentadienoic acid, 3-ethyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)-,methyl ester, (Z,E)- Chemical and Physical Properties
Names and Identifiers
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- 2,4-Pentadienoic acid, 3-ethyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)-,methyl ester, (Z,E)-
- 2,4-Pentadienoic acid, 3-ethyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, methyl ester, (2Z,4E)-
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- Inchi： 1S/C17H26O2/c1-6-14(12-16(18)19-5)9-10-15-13(2)8-7-11-17(15,3)4/h9-10,12H,6-8,11H2,1-5H3/b10-9+,14-12-
- InChI Key： KCIPYCXNIMRFKE-MVFBISMYSA-N
- SMILES： C(OC)(=O)/C=C(/CC)\C=C\C1C(C)(C)CCCC=1C
Computed Properties
- Exact Mass: 262.19338
Experimental Properties
- Density: 0.973±0.06 g/cm3(Predicted)
- Boiling Point: 351.1±11.0 °C(Predicted)
- PSA: 26.3
2,4-Pentadienoic acid, 3-ethyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)-,methyl ester, (Z,E)- Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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