Home Other Building Blocks 4-Hydroxy-4-methyl-2-pentanone

4-Hydroxy-4-methyl-2-pentanone

CAS No.:
123-42-2
Catalog Number:
AG000JX8
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$13
- +
25g
95%
In Stock USA
United States
$19
- +
100g
95%
In Stock USA
United States
$50
- +
500g
95%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG000JX8
Chemical Name:
4-Hydroxy-4-methyl-2-pentanone
CAS Number:
123-42-2
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
MDL Number:
MFCD00004471
IUPAC Name:
4-hydroxy-4-methylpentan-2-one
InChI:
InChI=1S/C6H12O2/c1-5(7)4-6(2,3)8/h8H,4H2,1-3H3
InChI Key:
SWXVUIWOUIDPGS-UHFFFAOYSA-N
SMILES:
CC(=O)CC(O)(C)C
EC Number:
204-626-7
UNII:
Q7WP157PTD
NSC Number:
9005
RTECS Number:
SA9100000
UN Number:
1148
Properties
Complexity:
94.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.084g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
116.16g/mol
Monoisotopic Mass:
116.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Literature
Title Journal
Precise hierarchical self-assembly of multicompartment micelles. Nature communications 20120227
A bio-catalytic approach to aliphatic ketones. Scientific reports 20120101
Mupirocin calcium microencapsulation via spray drying: feed solvent influence on microparticle properties, stability and antimicrobial activity. Drug development and industrial pharmacy 20111201
Molecular probes of the mechanism of cytochrome P450. Oxygen traps a substrate radical intermediate. Archives of biochemistry and biophysics 20110301
Fully automated screening of veterinary drugs in milk by turbulent flow chromatography and tandem mass spectrometry. Analytical and bioanalytical chemistry 20100801
A new automated approach to determine monosodium glutamate in dehydrated broths by using the flow-batch methodology. Talanta 20100415
Pyrolytic product characteristics of biosludge from the wastewater treatment plant of a petrochemical industry. Journal of hazardous materials 20091115
Diacetone alcohol, a dispersant solvent, contributes to acute toxicity of a fipronil-based insecticide in a passerine bird. Ecotoxicology and environmental safety 20081001
SPME-GC determination of potential volatile organic leachables in aqueous-based pharmaceutical formulations packaged in overwrapped LDPE vials. Journal of pharmaceutical and biomedical analysis 20080715
Comparison of a gas chromatography-optical fibre (GC-OF) detector with a gas chromatography-flame ionization detector (GC-FID) for determination of alcoholic compounds in industrial atmospheres. Talanta 20080715
Photochemistry of the indoor air pollutant acetone on Degussa P25 TiO2 studied by chemical ionization mass spectrometry. The journal of physical chemistry. A 20071220
Micro- and nanofabrication methods in nanotechnological medical and pharmaceutical devices. International journal of nanomedicine 20061201
Self-assembly of tin oxide nanoparticles: localized percolating network formation in polymer matrix. Langmuir : the ACS journal of surfaces and colloids 20061024
Oviposition in Delia platura (Diptera, Anthomyiidae): the role of volatile and contact cues of bean. Journal of chemical ecology 20060701
Isomerization of the protonated acetone dimer in the gas phase. Journal of mass spectrometry : JMS 20050801
L-proline catalyzed asymmetric transfer aldol reaction between diacetone alcohol and aldehydes. Chemical communications (Cambridge, England) 20041107
Safety assessment of MIBK (methyl isobutyl ketone). International journal of toxicology 20040101
The crystal structure of a novel copper(II) complex with asymmetric ligand derived from l-histidine. Inorganic chemistry 20031117
The OH-initiated oxidation of hexylene glycol and diacetone alcohol. Environmental science & technology 20030915
Decomposition of 2-bromophenol in NaOH solution at high temperature. Journal of hazardous materials 20030801
Gas-phase metal trications in protic solvent complexes. Journal of the American Chemical Society 20020710
Products and mechanism of the reaction of OH radicals with 2,2,4-trimethylpentane in the presence of NO. Environmental science & technology 20020215
Chemical composition and behavioral responses of the marine insect Halobates hawaiiensis (Heteroptera: Gerridae). Zeitschrift fur Naturforschung. C, Journal of biosciences 20010101
The genetic toxicology of some hydrocarbon and oxygenated solvents. Mutagenesis 19880501
Properties