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Home Fluorides 949898-58-2
949898-58-2,MFCD16620671
Catalog No.:AA00IILF

949898-58-2 | [1-Methyl-3-(trifluoromethyl)-1h-pyrazol-5-yl]methanol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$211.00   $148.00
- +
1g
95%
in stock  
$502.00   $352.00
- +
5g
95%
in stock  
$1,491.00   $1,044.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IILF
Chemical Name:
[1-Methyl-3-(trifluoromethyl)-1h-pyrazol-5-yl]methanol
CAS Number:
949898-58-2
Molecular Formula:
C6H7F3N2O
Molecular Weight:
180.1278
MDL Number:
MFCD16620671
SMILES:
OCc1cc(nn1C)C(F)(F)F
Properties
Computed Properties
 
Complexity:
161  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.3  

Downstream Synthesis Route

[1]Patent:WO2015/2994,2015,A2.Locationinpatent:Paragraph00187

[2]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.5199-5203

[3]Patent:WO2011/44001,2011,A1.Locationinpatent:Page/Pagecolumn34-35

[1]Sun,Aiming;Chandrakumar,Nizal;Yoon,Jeong-Joong;Plemper,RichardK.;Snyder,JamesP.[BioorganicandMedicinalChemistryLetters,2007,vol.17,#18,p.5199-5203]

[1]JournalofOrganicChemistry,2019,vol.84,p.15212-15225

Literature
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SDS
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Tags:949898-58-2 Molecular Formula|949898-58-2 MDL|949898-58-2 SMILES|949898-58-2 [1-Methyl-3-(trifluoromethyl)-1h-pyrazol-5-yl]methanol