Cas no 165047-92-7 (Cyclohexane,1,3-diethynyl-)
Cyclohexane,1,3-diethynyl- structure
Product Name:Cyclohexane,1,3-diethynyl-
CAS No:165047-92-7
MF:C10H12
MW:132.202282905579
CID:110501
Update Time:2024-01-24
Cyclohexane,1,3-diethynyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexane,1,3-diethynyl-
- Cyclohexane, 1,3-diethynyl- (9CI)
- Cyclohexane, 1,3-diethynyl-
-
- Inchi： 1S/C10H12/c1-3-9-6-5-7-10(4-2)8-9/h1-2,9-10H,5-8H2
- InChI Key： ZFNYENHXOKGAOJ-UHFFFAOYSA-N
- SMILES： C1(C#C)CCCC(C#C)C1
Computed Properties
- Exact Mass: 132.09396
- Monoisotopic Mass: 132.094
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 173
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 0A^2
Experimental Properties
- PSA: 0
Cyclohexane,1,3-diethynyl- Related Literature
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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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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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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