Cas no 156139-85-4 (1,1'-Bicyclohexyl,4-pentyl-4'-(1E)-1-propen-1-yl-, (trans,trans)-)
156139-85-4 structure
Product Name:1,1'-Bicyclohexyl,4-pentyl-4'-(1E)-1-propen-1-yl-, (trans,trans)-
CAS No:156139-85-4
MF:C20H36
MW:276.499846458435
CID:107279
PubChem ID:20594578
Update Time:2025-04-18
1,1'-Bicyclohexyl,4-pentyl-4'-(1E)-1-propen-1-yl-, (trans,trans)- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Bicyclohexyl,4-pentyl-4'-(1E)-1-propen-1-yl-, (trans,trans)-
- 1-pentyl-4-[4-[(E)-prop-1-enyl]cyclohexyl]cyclohexane
- trans,trans-4'-Pentyl-4-propenyl-bicyclohexyl
- TRANS,TRANS-4''-PENTYL-4-PROPENYL-BICYCLOHEXYL
- 4-Pentyl-4'-[(1E)-prop-1-en-1-yl]-1,1'-bi(cyclohexane)
- 156139-85-4
- TRANS,TRANS-4-PENTYL-4-PROPENYL-BICYCLOHEXYL
- DTXSID10608995
-
- Inchi： 1S/C20H36/c1-3-5-6-8-18-11-15-20(16-12-18)19-13-9-17(7-4-2)10-14-19/h4,7,17-20H,3,5-6,8-16H2,1-2H3/b7-4+
- InChI Key： ULZKWMBZCQZGMN-QPJJXVBHSA-N
- SMILES： C1(CCC(CCCCC)CC1)C1CCC(/C=C/C)CC1
Computed Properties
- Exact Mass: 276.28200
- Monoisotopic Mass: 276.282
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 20
- Rotatable Bond Count: 6
- Complexity: 262
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 0A^2
- XLogP3: 8.7
Experimental Properties
- PSA: 0.00000
- LogP: 6.75560
1,1'-Bicyclohexyl,4-pentyl-4'-(1E)-1-propen-1-yl-, (trans,trans)- Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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