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Cyclooctanone

CAS No.:
502-49-8
Catalog Number:
AG0034NT
Molecular Formula:
C8H14O
Molecular Weight:
126.1962
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$33
- +
5g
95%
In Stock USA
United States
$47
- +
25g
98%
In Stock USA
United States
$63
- +
100g
98%
In Stock USA
United States
$188
- +
500g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG0034NT
Chemical Name:
Cyclooctanone
CAS Number:
502-49-8
Molecular Formula:
C8H14O
Molecular Weight:
126.1962
MDL Number:
MFCD00001754
IUPAC Name:
cyclooctanone
InChI:
InChI=1S/C8H14O/c9-8-6-4-2-1-3-5-7-8/h1-7H2
InChI Key:
IIRFCWANHMSDCG-UHFFFAOYSA-N
SMILES:
O=C1CCCCCCC1
EC Number:
207-940-2
UNII:
Z4GO9P8SUZ
NSC Number:
9475
Properties
Complexity:
86.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.104g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.199g/mol
Monoisotopic Mass:
126.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
Phase transition from liquid to disordered solid phase of cyclooctanone studied with dielectric methods. The journal of physical chemistry. B 20120329
Synthesis and antimicrobial evaluation of some new cyclooctanones and cyclooctane-based heterocycles. Archiv der Pharmazie 20120301
Reactions of OH radicals with C6-C10 cycloalkanes in the presence of NO: isomerization of C7-C10 cycloalkoxy radicals. The journal of physical chemistry. A 20111222
Design and synthesis of highly reactive dienophiles for the tetrazine-trans-cyclooctene ligation. Journal of the American Chemical Society 20110629
(E)-2-(4-Fluoro-benzyl-idene)cyclo-octanone. Acta crystallographica. Section E, Structure reports online 20081201
Rh(I)-catalyzed intramolecular [3 + 2] cycloaddition of trans-vinylcyclopropane-enes. Journal of the American Chemical Society 20080611
2-Chloro-12-phenyl-6,7,8,9,10,11-hexa-hydro-cyclo-octa-[b]quinoline. Acta crystallographica. Section E, Structure reports online 20080501
Effect of cation absorption on ionization/dissociation of cycloketone molecules in a femtosecond laser field. The journal of physical chemistry. A 20070927
Total syntheses of conformationally locked difluorinated pentopyranose analogues and a pentopyranosyl phosphate mimetic. The Journal of organic chemistry 20070302
A novel and efficient synthesis of bicyclo[2.2.2]octenones and sigmatropic shifts in ground and excited states: stereoselective route to cis-decalins and diquinane frameworks. The Journal of organic chemistry 20050204
Intramolecular aldol cyclization of C-4-ulopyranosyl-2'-oxoalkanes controlled by steric effects. Asymmetric synthesis of substituted 8-oxabicyclo[3.2.1]octanones and -octenones and cyclopentenones. Carbohydrate research 20041020
Synthesis of stereoisomeric medium-ring alpha,alpha'-dihydroxy cycloalkanones. The Journal of organic chemistry 20040402
The formation of bicyclo[n.2.0]alkan-1-ols from the reaction of the lithium enolates of simple ketones and phenyl vinyl sulfoxide. Organic & biomolecular chemistry 20030421
Acetal-vinyl sulfide cyclization on sugar substrates: effect of structure and substituent. The Journal of organic chemistry 20030207
In vitro co-metabolism of ethanol and cyclic ketones. Toxicology 20020815
Selective oxidation of cyclooctane to cyclootanone with molecular oxygen in the presence of compressed carbon dioxide. Chemical communications (Cambridge, England) 20020307
Total synthesis of (+/-)-asteriscanolide. The Journal of organic chemistry 20011102
Stereoselective transformations on D-glucose-derived eight-membered ring carbocycles. Organic letters 20010308
Properties