Cas no 71186-24-8 (Cyclohexene, 6-(2-butenylidene)-1,5,5-trimethyl-, (E,Z)-)
71186-24-8 structure
Product Name:Cyclohexene, 6-(2-butenylidene)-1,5,5-trimethyl-, (E,Z)-
CAS No:71186-24-8
MF:C13H20
MW:176.297904014587
CID:545928
Update Time:2024-03-05
Cyclohexene, 6-(2-butenylidene)-1,5,5-trimethyl-, (E,Z)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexene, 6-(2-butenylidene)-1,5,5-trimethyl-, (E,Z)-
- (6E)-6-[(Z)-2-Butenylidene]-1,5,5-trimethyl-1-cyclohexene
- (2Z)-4-[(1E)-2,6,6-Trimethyl-2-cyclohexen-1-ylidene]-2-butene
- (6E,8Z)-Megastigma-4,6,8-triene
- Cyclohexene, 6-(2Z)-2-buten-1-ylidene-1,5,5-trimethyl-, (6E)-
-
- Inchi： 1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-6,8-9H,7,10H2,1-4H3/b6-5?,12-9-
- InChI Key： BYDQKMZEOZVIJM-DZSVHYLSSA-N
- SMILES： C1(C)/C(=C/C=CC)/C(C)(C)CCC=1
Computed Properties
- Exact Mass: 176.157
- Monoisotopic Mass: 176.157
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 262
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 0A^2
Experimental Properties
- Density: 0.881±0.06 g/cm3(Predicted)
- Boiling Point: 237.9±7.0 °C(Predicted)
Cyclohexene, 6-(2-butenylidene)-1,5,5-trimethyl-, (E,Z)- Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Ke Chen,Shuai Liu,Liang Mei,Feng Jin,Bo Zhang,Fengxiang Ma,Yewei Chen,Hong Deng,Min Guo,Qingxu Yu Analyst, 2020,145, 1524-1530
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Soumaya Khlifi,Gregory Mouille,Jonathan Farjon Anal. Methods, 2017,9, 2328-2333
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