Cas no 31454-48-5 (Cyclooctane,tetrabromo-)
Cyclooctane,tetrabromo- structure
Product Name:Cyclooctane,tetrabromo-
CAS No:31454-48-5
MF:C8H12Br4
MW:427.796879768372
CID:311895
PubChem ID:3084540
Update Time:2025-04-19
Cyclooctane,tetrabromo- Chemical and Physical Properties
Names and Identifiers
-
- Cyclooctane,tetrabromo-
- 1,1,2,2-tetrabromocyclooctane
- 1,3,5,7-tetrabromocyclooctane
- Tetrabromocyclooctane
- EINECS 250-640-1
- DTXSID90953470
- 31454-48-5
-
- Inchi： 1S/C8H12Br4/c9-5-1-6(10)3-8(12)4-7(11)2-5/h5-8H,1-4H2
- InChI Key： RTLBBTQCDMYRRE-UHFFFAOYSA-N
- SMILES： BrC1CC(CC(CC(C1)Br)Br)Br
Computed Properties
- Exact Mass: 423.76716
- Monoisotopic Mass: 423.767251
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 91
- 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: 0
- XLogP3: 4.7
Experimental Properties
- Density: 2.145
- Boiling Point: 371.4°Cat760mmHg
- Flash Point: 173.5°C
- Refractive Index: 1.598
- PSA: 0
Cyclooctane,tetrabromo- Related Literature
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Pernilla Bohlin,Ond?ej Audy,Lenka ?krdlíková,Petr Kuku?ka,?imon Vojta,Petra P?ibylová,Roman Proke?,Pavel ?upr,Jana Klánová Environ. Sci.: Processes Impacts 2014 16 2617
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P. Bohlin,O. Audy,L. ?krdlíková,P. Kuku?ka,P. P?ibylová,R. Proke?,?. Vojta,J. Klánová Environ. Sci.: Processes Impacts 2014 16 433
-
Frank Wania,Chubashini Shunthirasingham Environ. Sci.: Processes Impacts 2020 22 1925
-
William O. Jones J. Chem. Soc. 1954 312
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