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830-13-7 | Cyclododecanone
CAS No: 830-13-7 Catalog No: AG003P41 MDL No:MFCD00003722
Product Description
Catalog Number:
AG003P41
Chemical Name:
Cyclododecanone
CAS Number:
830-13-7
Molecular Formula:
C12H22O
Molecular Weight:
182.3025
MDL Number:
MFCD00003722
IUPAC Name:
cyclododecanone
InChI:
InChI=1S/C12H22O/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h1-11H2
InChI Key:
SXVPOSFURRDKBO-UHFFFAOYSA-N
SMILES:
O=C1CCCCCCCCCCC1
EC Number:
212-595-6
UNII:
WL053118A9
NSC Number:
77116
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.167g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.307g/mol
Monoisotopic Mass:
182.167g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Literature
| Title | Journal |
|---|---|
| N'-Cyclo-dodecyl-idene-pyridine-4-carbohydrazide. | Acta crystallographica. Section E, Structure reports online 20120401 |
| Structure-activity relationship for the first-in-class clinical steroid sulfatase inhibitor Irosustat (STX64, BN83495). | ChemMedChem 20111104 |
| Bioproduction of lauryl lactone and 4-vinyl guaiacol as value-added chemicals in two-phase biotransformation systems. | Applied microbiology and biotechnology 20091001 |
| Investigation on the Beckmann rearrangement reaction catalyzed by porous solids: MAS NMR and theoretical calculations. | Solid state nuclear magnetic resonance 20090401 |
| Design, synthesis, and fungicidal activity of macrolactones and macrolactams with a sulfonamide side chain. | Journal of agricultural and food chemistry 20080813 |
| Beckmann rearrangement of ketoximes to lactams by triphosphazene catalyst. | The Journal of organic chemistry 20080404 |
| 2-(Methyl-sulfan-yl)cyclo-dodeca-none tosyl-hydrazone. | Acta crystallographica. Section E, Structure reports online 20080401 |
| Cyanuric chloride as a mild and active Beckmann rearrangement catalyst. | Journal of the American Chemical Society 20050817 |
| Sesquiterpenes from the red alga Laurencia tristicha. | Journal of natural products 20050601 |
| Synthesis and fungicidal activity of novel 2-oxocycloalkylsulfonylureas. | Journal of agricultural and food chemistry 20050323 |
| The gossypol-cyclododecanone (1/2) inclusion complex. | Acta crystallographica. Section C, Crystal structure communications 20030701 |
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