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149105-25-9,MFCD03411589
Catalog No.:AA00HXLV

149105-25-9 | methyl 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$411.00   $288.00
- +
5g
98%
in stock  
$1,407.00   $985.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00HXLV
Chemical Name:
methyl 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoate
CAS Number:
149105-25-9
Molecular Formula:
C16H24O3
Molecular Weight:
264.3600
MDL Number:
MFCD03411589
SMILES:
COC(=O)C(CCCOc1cc(C)ccc1C)(C)C
Properties
Computed Properties
 
Complexity:
286  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
7  
XLogP3:
4.1  

Downstream Synthesis Route

[1]Nunna,Rambabu;Jayanna;Ramachandran[AsianJournalofChemistry,2015,vol.27,#3,p.925-928]

[2]CurrentPatentAssignee:CHINAPHARMACEUTICALUNIVERSITY-CN114149341,2022,ALocationinpatent:Paragraph0049;0056-0057

[3]CurrentPatentAssignee:CHINAPHARMACEUTICALUNIVERSITY-CN114149341,2022,ALocationinpatent:Paragraph0049-0051;0056-0057

[4]CurrentPatentAssignee:JIANGSUCAREPHARPHARMACEUTICAL-CN111333685,2020,ALocationinpatent:Paragraph0016;0020-0021

[1]Liu,Mingyang;Han,Buxing;Dyson,PaulJ.[AngewandteChemie-InternationalEdition,2022,vol.61,#40][Angew.Chem.,2022,vol.134,#40]

Literature

Title: Studies to further investigate the inhibition of human liver microsomal CYP2C8 by the acyl-β-glucuronide of gemfibrozil.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20111201

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SDS
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Tags:149105-25-9 Molecular Formula|149105-25-9 MDL|149105-25-9 SMILES|149105-25-9 methyl 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoate