Home Other Building Blocks 100117-62-2
100117-62-2,MFCD01311166
Catalog No.:AA0000X8

100117-62-2 | Ethyl 3,5-dimethylbenzoylformate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
96%
in stock  
$122.00   $85.00
- +
1g
96%
in stock  
$229.00   $160.00
- +
5g
96%
in stock  
$658.00   $460.00
- +
25g
96%
in stock  
$1,865.00   $1,305.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0000X8
Chemical Name:
Ethyl 3,5-dimethylbenzoylformate
CAS Number:
100117-62-2
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
MDL Number:
MFCD01311166
SMILES:
CCOC(=O)C(=O)c1cc(C)cc(c1)C
Properties
Computed Properties
 
Complexity:
237  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
4  
XLogP3:
2.8  

Downstream Synthesis Route

[1]Smithetal.[JournalofOrganicChemistry,1959,vol.24,p.1301,1305]

[1]Smithetal.[JournalofOrganicChemistry,1959,vol.24,p.1301,1305]

100117-62-2   
(S)-(3,5-Dimethyl-phenyl)-hydroxy-aceticacidethylester 
 
(R)-(3,5-Dimethyl-phenyl)-hydroxy-aceticacidethylester 

[1]Diezi,Simon;Reimann,Sven;Bonalumi;Mallat,Tamas;Baiker,Alfons[JournalofCatalysis,2006,vol.239,#2,p.255-262]

[1]Zhang,Wen;Shi,Min[ChemicalCommunications,2006,#11,p.1218-1220]

[2]Jia,Yi-Xia;Hillgren,J.Mikael;Watson,EmmaL.;Marsden,StephenP.;Kuendig,E.Peter[ChemicalCommunications,2008,#34,p.4040-4042]

[1]Smithetal.[JournalofOrganicChemistry,1959,vol.24,p.1301,1305]

Literature
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SDS
Tags:100117-62-2 Molecular Formula|100117-62-2 MDL|100117-62-2 SMILES|100117-62-2 Ethyl 3,5-dimethylbenzoylformate