Cas no 159524-85-3 (Cyclohexane,1-ethynyl-4-propyl-, trans-)
159524-85-3 structure
Product Name:Cyclohexane,1-ethynyl-4-propyl-, trans-
CAS No:159524-85-3
MF:C11H18
MW:150.260623455048
CID:109243
PubChem ID:21870626
Update Time:2025-04-18
Cyclohexane,1-ethynyl-4-propyl-, trans- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexane,1-ethynyl-4-propyl-, trans-
- Cyclohexane, 1-ethynyl-4-propyl-, trans- (9CI)
- trans-1-ethynyl-4-propylcyclohexane
- MBEZLGBHXUTCKY-XYPYZODXSA-N
- A1-31676
- MBEZLGBHXUTCKY-UHFFFAOYSA-N
- (1s,4r)-1-Ethynyl-4-propylcyclohexane
- 1-ethynyl-4-propylcyclohexane
- 159524-85-3
-
- Inchi： 1S/C11H18/c1-3-5-11-8-6-10(4-2)7-9-11/h2,10-11H,3,5-9H2,1H3
- InChI Key： MBEZLGBHXUTCKY-UHFFFAOYSA-N
- SMILES： C1(CCC)CCC(C#C)CC1
Computed Properties
- Exact Mass: 150.14094
- Monoisotopic Mass: 150.141
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 141
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 0A^2
- XLogP3: 4.4
Experimental Properties
- PSA: 0
Cyclohexane,1-ethynyl-4-propyl-, trans- Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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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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