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3952-66-7,MFCD03093092
Catalog No.:AA003RMA

3952-66-7 | Methyl 2-oxobutanoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$59.00   $42.00
- +
5g
95%
in stock  
$139.00   $97.00
- +
25g
95%
in stock  
$393.00   $275.00
- +
100g
95%
in stock  
$1,154.00 $808.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003RMA
Chemical Name:
Methyl 2-oxobutanoate
CAS Number:
3952-66-7
Molecular Formula:
C5H8O3
Molecular Weight:
116.1152
MDL Number:
MFCD03093092
SMILES:
CCC(=O)C(=O)OC
Properties
Properties
 
BP:
154°C at 760 mmHg  
Form:
Liquid  
MP:
-47°C  
Refractive Index:
1.4099 (589.3 nm 30℃)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
106  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.5  

Downstream Synthesis Route

[1]HelveticaChimicaActa,1947,vol.30,p.1349,1366

[1]HelveticaChimicaActa,1960,vol.43,p.1840-1844

[2]JournalofOrganicChemistry,1995,vol.60,p.5174-5179

[1]JustusLiebigsAnnalenderChemie,1977,p.664-686

[1]JustusLiebigsAnnalenderChemie,1977,p.664-686

[1]JournalofOrganicChemistry,1963,vol.28,p.215-217

Literature
Quotation Request
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SDS
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Tags:3952-66-7 Molecular Formula|3952-66-7 MDL|3952-66-7 SMILES|3952-66-7 Methyl 2-oxobutanoate
Catalog No.: AA003RMA
3952-66-7,MFCD03093092
3952-66-7 | Methyl 2-oxobutanoate
Pack Size： 1g
Purity： 95%
in stock
$59.00 $42.00
Pack Size： 5g
Purity： 95%
in stock
$139.00 $97.00
Pack Size： 25g
Purity： 95%
in stock
$393.00 $275.00
Pack Size： 100g
Purity： 95%
in stock
$1,154.00 $808.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003RMA
Chemical Name: Methyl 2-oxobutanoate
CAS Number: 3952-66-7
Molecular Formula: C5H8O3
Molecular Weight: 116.1152
MDL Number: MFCD03093092
SMILES: CCC(=O)C(=O)OC
Properties
BP: 154°C at 760 mmHg  
Form: Liquid  
MP: -47°C  
Refractive Index: 1.4099 (589.3 nm 30℃)  
Storage: Keep in dry area;Room Temperature;  
Complexity: 106  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 8  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.5  
Downstream Synthesis Route
67-56-1    71126-34-6    3952-66-7 

[1]HelveticaChimicaActa,1947,vol.30,p.1349,1366

186581-53-3    600-18-0    3952-66-7 

[1]HelveticaChimicaActa,1960,vol.43,p.1840-1844

[2]JournalofOrganicChemistry,1995,vol.60,p.5174-5179

3952-66-7    31460-03-4    63613-51-4 

[1]JustusLiebigsAnnalenderChemie,1977,p.664-686

3952-66-7    31460-03-4    63613-52-5 

[1]JustusLiebigsAnnalenderChemie,1977,p.664-686

59906-50-2    3952-66-7 

[1]JournalofOrganicChemistry,1963,vol.28,p.215-217

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