Cas no 59346-70-2 (Pentacyclo[4.2.0.02,5.03,8.04,7]octane,1,4-dibromo-)
![Pentacyclo[4.2.0.02,5.03,8.04,7]octane,1,4-dibromo- structure](https://ossimg.kuujia.com/scimg/59500/59346-70-2x500.png)
59346-70-2 structure
Product Name:Pentacyclo[4.2.0.02,5.03,8.04,7]octane,1,4-dibromo-
CAS No:59346-70-2
MF:C8H6Br2
MW:261.941240787506
CID:383578
PubChem ID:143612
Update Time:2025-04-19
Pentacyclo[4.2.0.02,5.03,8.04,7]octane,1,4-dibromo- Chemical and Physical Properties
Names and Identifiers
-
- Pentacyclo[4.2.0.02,5.03,8.04,7]octane,1,4-dibromo-
- 1,4-Dibromocubane
- 59346-70-2
- Pentacyclo(4.2.0.02,5.03,8.04,7)octane,1,4-dibromo-
- DTXSID10208095
-
- Inchi： 1S/C8H6Br2/c9-7-1-2-4(7)6-5(7)3(1)8(2,6)10/h1-6H
- InChI Key： RXSZHUHIWVMHRU-UHFFFAOYSA-N
- SMILES： BrC12C3C4C1C1C2C3C14Br
Computed Properties
- Exact Mass: 259.88358
- Monoisotopic Mass: 259.88363g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 212
- 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
- XLogP3: 1.9
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Pentacyclo[4.2.0.02,5.03,8.04,7]octane,1,4-dibromo- Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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