Bicyclo[2.2.2]octane

CAS 280-33-1 MFCD00213540

化学结构图

280-33-1
SMILES: C1CC2CCC1CC2

化学属性

Mol. FormulaC8H14
Mol. Weight110.22

别名和识别编码

Chemical NameBicyclo(2.2.2)octane
Synonym 1,4-Endoethylenecyclohexane 1,4-ethylenecyclohexane Bicyclo-(2,2,2)-octan bicyclo(2.2.2)octane bicyclo(3.2.1)octane bicyclo[2.2.2]-octane bicyclo[2.2.2]octane cyclohexane, 1,4-(1,2-ethanediyl)-
Wiswesser Line NotationL66 A BTJ
CAS Number280-33-1
InChIKeyGPRLTFBKWDERLU-UHFFFAOYSA-N
PubChem Substance ID9235
InChIInChI=1S/C8H14/c1-2-8-5-3-7(1)4-6-8/h7-8H,1-6H2
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分类

  • {uni_hamburg} no charge; carbocycle; alicycle; fused rings; 6RingOnly; 6ring; 1fragment

相关文献及参考

  • Short: II/25D Title: Structure Data of Free Polyatomic Molecules: Molecules Containing Five or More Carbon Atoms Author: Graner, G.; Hirota, E.; Iijima, T.; Kuchitsu, K.; Ramsay, D.A.; Vogt, J.; Vogt, N. Editor: Kuchitsu, K. Source: Landolt-Börnstein, New Series Volume: II/25D Year: 2003 Keyword: Free Polyatomic Molecules; Carbon Atoms; Molecules ISBN: 3-540-42860-7 ISBN: 978-3-540-42860-2 Internet Resource: DOI:10.1007/b75952 RefComment: VIII, 569 pages. Hardcover RefComment: Written for scientists and researchers in the fields of chemistry and physics Abstract: This fourth subvolume presents data on the geometric parameters (internuclear distances, bond angles, dihedral angles of internal rotation etc) of free polyatomic molecules including free radicals and molecular ions. The survey on structure data consists of four subvolumes, each containing the geometric parameters determined in the gas phase either by an analysis of the rotational constants (and sometimes the vibrational constants) obtained from microwave, infrared, Raman, electronic and photoelectron spectroscopy or by an analysis of electron diffraction intensities. Most of the structures listed in the tables are for molecules in the electronic ground state, but structures for electronically excited states have also been included as far as they are available. In this fourth subvolume, the structure of molecules containing five to sixty carbon atoms is listed.
  • Short: III/33B1 Title: Diffusion in Semiconductors and Non-Metallic Solids: Diffusion in Non-Metallic Solids (Part 1) without Volume Diffusion in Oxides Author: Allen, C.E.; Beke, D.L.; Bénière, F.; Bruff, C.M.; Chadwick, A.V.; Erdélyi, G.; Faupel, F.; Hsieh, C.H.; Jain, H.; Kroll, G.; Matzke, H.; Murch, G.E.; Rondinella, V.V.; Seebauer, E.G. Editor: Beke, D.L. Source: Landolt-Börnstein, New Series Volume: III/33B1 Year: 1999 ISBN: 3-540-62391-4 ISBN: 978-3-540-62391-5 Internet Resource: DOI:10.1007/b59654 RefComment: 4

安全信息

RTECSDT7890000
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 250 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - changes in motor activity (specific assay)
   Behavioral - ataxia
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   36,261,1976

系列性分类


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