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13672-64-5,MFCD09030137
Catalog No.:AA00127E

13672-64-5 | Methyl 2-(2-oxocyclohexyl)acetate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$440.00   $308.00
- +
100mg
95%
3 weeks  
$600.00   $420.00
- +
250mg
95%
3 weeks  
$809.00   $567.00
- +
500mg
95%
3 weeks  
$1,209.00   $847.00
- +
1g
95%
3 weeks  
$1,517.00   $1,062.00
- +
2.5g
95%
3 weeks  
$2,863.00   $2,004.00
- +
5g
95%
3 weeks  
$4,181.00   $2,927.00
- +
10g
95%
3 weeks  
$6,143.00   $4,300.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00127E
Chemical Name:
Methyl 2-(2-oxocyclohexyl)acetate
CAS Number:
13672-64-5
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
MDL Number:
MFCD09030137
SMILES:
COC(=O)CC1CCCCC1=O
Properties
Computed Properties
 
Complexity:
186  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.8  

Downstream Synthesis Route

[1]Bailey,D.M.etal.[JournalofOrganicChemistry,1963,vol.28,p.610-614]

[1]Noyori,R.;Nishida,I.;Sakata,J.[JournaloftheAmericanChemicalSociety,1983,vol.105,#6,p.1598-1608]

[2]Kuwajima,Isao;Nakamura,Eiichi;Shimizu,Makoto[JournaloftheAmericanChemicalSociety,1982,vol.104,#4,p.1025-1030]

[3]Noyori;Nishida;Sakata[TetrahedronLetters,1980,vol.21,#21,p.2085-2088]

Literature

Title: Syntheses of (+)- and (-)-dihydropinidine and (+)- and (-)-epidihydropinidine by using yeast reduction of methyl (2-oxocyclohexyl)acetate.

Journal: Bioscience, biotechnology, and biochemistry 20040301

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SDS
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