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5077-67-8,MFCD00010259
Catalog No.:AA00DBA0

5077-67-8 | 1-Hydroxybutan-2-one

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Purity
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Price(USD)
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250mg
96%
in stock  
$36.00   $25.00
- +
1g
96%
in stock  
$44.00   $31.00
- +
5g
96%
in stock  
$197.00   $138.00
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10g
96%
in stock  
$384.00   $269.00
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25g
96%
in stock  
$704.00   $493.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DBA0
Chemical Name:
1-Hydroxybutan-2-one
CAS Number:
5077-67-8
Molecular Formula:
C4H8O2
Molecular Weight:
88.1051
MDL Number:
MFCD00010259
SMILES:
CCC(=O)CO
FEMA Number:
3173
Properties
Computed Properties
 
Complexity:
49.5  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
-0.2  

Downstream Synthesis Route

[1]JustusLiebigsAnnalenderChemie,1930,vol.484,p.17

[1]Patent:US2689253,1950,

[1]Patent:US2689253,1950,

[1]AnnalesdeChimie(Cachan,France),1934,vol.<11>1,p.27    Kolloid-Zeitschrift,1933,vol.63,p.86

[1]IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1949,p.292    Chem.Abstr.,1949,p.6624

Literature

Title: Ethyl 2-[1,3-dioxo-6-(piperidin-1-yl)-2,3-dihydro-1H-benz[de]isoquinolin-2-yl]acetate.

Journal: Acta crystallographica. Section E, Structure reports online 20110701

Title: Broadening deoxysugar glycodiversity: natural and engineered transaldolases unlock a complementary substrate space.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20110225

Title: Ethyl 2-(2-oxo-4-phenyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)acetate.

Journal: Acta crystallographica. Section E, Structure reports online 20100801

Title: Synthesis and evaluation of the cytotoxicity of apoptolidinones A and D.

Journal: The Journal of organic chemistry 20080704

Title: D-Fructose-6-phosphate aldolase-catalyzed one-pot synthesis of iminocyclitols.

Journal: Journal of the American Chemical Society 20071128

Title: Impairment of mitochondrial acetoacetyl CoA thiolase activity in the colonic mucosa of patients with ulcerative colitis.

Journal: Gut 20071101

Title: Protonation thermochemistry of selected hydroxy- and methoxycarbonyl molecules.

Journal: The journal of physical chemistry. A 20051229

Title: Characterization of the beta-carbon processing reactions of the mammalian cytosolic fatty acid synthase: role of the central core.

Journal: Biochemistry 20040817

Title: Detection of carboxylic acids and inhibition of hippuric acid formation in rats treated with 3-butene-1,2-diol, a major metabolite of 1,3-butadiene.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20030801

Title: Stereoselective oxidation of aliphatic diols and reduction of hydroxy-ketones with galactitol dehydrogenase from Rhodobacter sphaeroides D.

Journal: Communications in agricultural and applied biological sciences 20030101

Title: In vitro metabolism of chloroprene: species differences, epoxide stereochemistry and a de-chlorination pathway.

Journal: Chemical research in toxicology 20011101

Title: Modification of fatty acids changes the flavor volatiles in tomato leaves.

Journal: Phytochemistry 20010901

Title: Vanessa Faugeroux, et al. Synthesis and biological evaluation of conformationally constrained analogues of the antitubercular agent ethambutol. Bioorg Med Chem. 2007 Sep 1;15(17):5866-76.

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