CYCLOOCTANE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H16
Molecular Weight	112.2126
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C1CCCCCCC1

InChI

InChIKey=WJTCGQSWYFHTAC-UHFFFAOYSA-N

InChI=1S/C8H16/c1-2-4-6-8-7-5-3-1/h1-8H2

HIDE SMILES / InChI

Molecular Formula	C8H16
Molecular Weight	112.2126
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Synthesis of oligoribonucleic acid conjugates using a cyclooctyne phosphoramidite.	2010-12-03	21049910
4,5,6,7,8,9-Hexahydro-2H-cyclo-octa[c]pyrazol-1-ium-3-olate.	2010-10-31	21589177
syn-Dispiro-[1,3-dioxolane-2,17'-penta-cyclo-[12.2.1.1.0.0]octa-decane-18',2''-[1,3]dioxolane]-7',15'-diene.	2010-10-20	21589061
Formation of uranium(IV) oxide clusters from uranocene [U(eta(8)-C8H8)2] and uranyl [UO2X2] compounds.	2010-09-06	20799742
Rate coefficients for cycloalkyl + O reactions and product branching in the decomposition of chemically activated cycloalkoxy radicals: an experimental and theoretical study.	2010-08-21	20520884
Theoretical studies of An(II)(2)(C(8)H(8))(2) (An = Th, Pa, U, and Np) complexes: the search for double-stuffed actinide metallocenes.	2010-07-19	20545320
anti-1',6',7',8',9',14',15',16'-Octa-chloro-dispiro-[1,3-dioxolane-2,17'-penta-cyclo-[12.2.1.1.0.0]octa-decane-18',2''-1,3-dioxolane]-7',15'-diene.	2010-07-03	21588218
Topology of cyclo-octane energy landscape.	2010-06-21	20572697
Metalloradical-catalyzed aliphatic carbon-carbon activation of cyclooctane.	2010-05-26	20441175
Zirconium complex of an [OSSO]-type diphenolate ligand bearing trans-1,2-cyclooctanediylbis(thio) core: synthesis, structure, and isospecific 1-hexene polymerization.	2009-09-30	19456159
Clickable fluorophores for biological labeling--with or without copper.	2009-09-07	19675904
Solvation shell structure of cyclooctylpyranone in water solvent and its comparative structure, dynamics and dipole moment in HIV protease.	2009-08-14	19809680
Are the ground states of the later actinocenes multiconfigurational? All-electron spin-orbit coupled CASPT2 calculations on An(eta(8)-C8H8)2 (An = Th, U, Pu, Cm).	2009-07-30	19719318
Effects of native organic material and water on sorption properties of reference diesel soot.	2009-05-01	19534133
Rate constants of nine C6-C9 alkanes with OH from 230 to 379 K: chemical tracers for [OH].	2009-04-30	19334733
Ring strain energy in the cyclooctyl system. The effect of strain energy on [3 + 2] cycloaddition reactions with azides.	2009-04-15	19301865
Characterization of sorbent properties of soil organic matter and carbonaceous geosorbents using n-alkanes and cycloalkanes as molecular probes.	2009-01-15	19238970
High temperature metal hydrides as heat storage materials for solar and related applications.	2009-01	19333448
Tetrazine ligation: fast bioconjugation based on inverse-electron-demand Diels-Alder reactivity.	2008-10-15	18798613
Algorithmic dimensionality reduction for molecular structure analysis.	2008-08-14	18715062
2-Chloro-12-phenyl-6,7,8,9,10,11-hexa-hydro-cyclo-octa-[b]quinoline.	2008-04-10	21202320
Catalytic ring expansion, contraction, and metathesis-polymerization of cycloalkanes.	2008-01-14	18092104
Transformation of the hexagonal-structure clathrate hydrate of cyclooctane to a low-symmetry form below 167 k.	2008	18979473
Linear uranium complexes X2UL5 with L=cyanide, isocyanate: DFT evidence for similarities between uranyl (X=O) and uranocene (X=Cp) derivatives.	2008	18181129
Packing in three cyclooctitol acetates.	2007-12	18057624
1'-Methylcyclooctane-1-spiro-3'-pyrrolidine-2'-spiro-3''-indoline-2,2''-dione and 1,1'-dimethylpiperidine-3-spiro-3'-pyrrolidine-2'-spiro-3''-indoline-2'',4-dione.	2007-09	17762127
Bicyclic phosphines as ligands for cobalt catalysed hydroformylation. Crystal structures of [Co(Phoban[3.3.1]-Q)(CO)(3)](2) (Q = C(2)H(5), C(5)H(11), C(3)H(6)NMe(2), C(6)H(11)).	2007-07-21	17607402
Phenalenyl-based neutral radical molecular conductors: substituent effects on solid-state structures and properties.	2007-06-06	17500519
Cyclooctane tropospheric degradation initiated by reaction with C1 atoms.	2007-05	17561776
Synthesis and catalytic properties in olefin epoxidation of novel iron(II) complexes with pyridine-containing macrocycles bearing an aminopropyl pendant arm.	2007-04-02	17335276
Thermal diffusion of dilute polymer solutions: the role of solvent viscosity.	2006-12-07	17166046
Encapsulation of a guest molecule in a strained form: an extended 36-membered dodecanuclear manganese metallamacrocycle that accommodates a cyclooctane in the S4 symmetry conformation.	2006-09-21	17047816
Saturated hydrocarbon-benzene complexes: theoretical study of cooperative CH/pi interactions.	2006-08-10	16884202
From common carbohydrates to enantiopure cyclooctane polyols and glycomimetics via deoxygenative zirconocene ring contraction.	2006-06-09	16749762
Transition-metal (Ti,V,Cr,Mn,Fe,Co,Cu) containing ordered nanoporous materials: novel heterogeneous catalysts for selective oxidation reactions.	2006-06	17025080
Three-carbon Dowd-Beckwith ring expansion reaction versus intramolecular 1,5-hydrogen transfer reaction: a theoretical study.	2005-11-11	16268616
Studies toward the total synthesis of vinigrol. synthesis of the octalin ring.	2005-10-28	16238317
Bayesian methods for the conformational classification of eight-membered rings.	2005-10	16186659
Studies towards the total synthesis of di- and sesterterpenes with dicyclopenta[a,d]cyclooctane skeletons. Three-component approach to the A/B rings building block.	2005-09-30	18007374
Exploratory studies aimed at a synthesis of vinigrol. 2. Attempts to exploit ring-closing metathesis for construction of the central cyclooctane belt.	2005-01-21	15651793
Phase relationships and thermodynamic interactions of isotactic poly(1-butene) and organic solvent systems.	2005-01-07	15558808
Conformational investigations on analogs of inflammation response inducing chemotactic tripeptide fMLP.	2005	15648091
A combined experimental and computational study of dihydrido(phosphinooxazoline)iridium complexes.	2004-11-03	15506783
Effect of surface wettability on the adhesion of proteins.	2004-08-31	15323531
Mechanistic studies of the transfer dehydrogenation of cyclooctane catalyzed by iridium bis(phosphinite) p-XPCP pincer complexes.	2004-08-04	15281824
Alkane oxidation via photochemical excitation of a self-assembled molecular cage.	2004-08-04	15281793
Carbamoylphosphonates, a new class of in vivo active matrix metalloproteinase inhibitors. 1. Alkyl- and cycloalkylcarbamoylphosphonic acids.	2004-05-20	15139760
Peptide helices with pendant cycloalkane rings. Characterization of conformations of 1-aminocyclooctane-1-carboxylic acid (Ac8c) residues in peptides.	2004-03	15113088
Raman under nitrogen. The high-resolution Raman spectroscopy of crystalline uranocene, thorocene, and ferrocene.	2004-02-08	15268415
The effect of a hydroxy protecting group on the PtCl2-catalyzed cyclization of dienynes--a novel, efficient, and selective synthesis of carbocycles.	2002-06-17	19746619

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:35:14 GMT 2025` Edited by `admin` on `Mon Mar 31 18:35:14 GMT 2025`
Record UNII	KKZ3KBS654
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-72426

Preferred Name

English

CYCLOOCTANE

Systematic Name

English

1,2-CYCLOOCTANE

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

206-031-8