Cas no 1129-90-4 (Cyclododecyne)
Cyclododecyne structure
Product Name:Cyclododecyne
Cyclododecyne Chemical and Physical Properties
Names and Identifiers
-
- Cyclododecyne
- 1129-90-4
- 1-Cyclododecyne
- 1-Cyclododecyne #
- BYDOJAHKOHCERE-UHFFFAOYSA-N
- Q27117279
- DTXSID30150209
- CHEBI:37819
-
- Inchi： 1S/C12H20/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-10H2
- InChI Key： BYDOJAHKOHCERE-UHFFFAOYSA-N
- SMILES： C1CCCCC#CCCCCC1
Computed Properties
- Exact Mass: 164.1566
- Monoisotopic Mass: 164.156501
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 139
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 5.3
- Topological Polar Surface Area: 0
Experimental Properties
- Density: 0.85
- Boiling Point: 247.7°Cat760mmHg
- Flash Point: 95°C
- Refractive Index: 1.471
- PSA: 0
Cyclododecyne Related Literature
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1. PhSeOTf–Et3N·3HF and PhSeSbF6–Et3N·3HF as new PhSe–F equivalents in the fluoroselenenylation of acetylenesHelmut Poleschner,Konrad Seppelt J. Chem. Soc. Perkin Trans. 1 2002 2668
-
Anja K?nig,Christoph Wagner,Martin Bette,Dirk Steinborn Dalton Trans. 2012 41 7156
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Si-Chen Tao,Fan-Cheng Meng,Tie Wang,Yan-Long Zheng Chem. Sci. 2023 14 2040
-
Si-Chen Tao,Fan-Cheng Meng,Tie Wang,Yan-Long Zheng Chem. Sci. 2023 14 2040
-
Samir Z. Zard Chem. Commun. 2002 1555
1129-90-4 (Cyclododecyne) Related Products
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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