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23170-45-8,MFCD07357354
Catalog No.:AA002MD2

23170-45-8 | Methyl 3-methyl-1H-pyrazole-4-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$19.00   $14.00
- +
1g
95%
in stock  
$37.00   $26.00
- +
5g
95%
in stock  
$131.00   $92.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002MD2
Chemical Name:
Methyl 3-methyl-1H-pyrazole-4-carboxylate
CAS Number:
23170-45-8
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
MDL Number:
MFCD07357354
SMILES:
COC(=O)c1c[nH]nc1C
Properties
Computed Properties
 
Complexity:
138  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.5  

Upstream Synthesis Route

[1]Patent:WO2006/74281,2006,A2,.Locationinpatent:Page/Pagecolumn42

[1]Patent:WO2013/120104,2013,A2,.Locationinpatent:Paragraph00183;00184

[2]BioorganicandMedicinalChemistryLetters,2015,vol.25,#17,p.3644-3649

[3]AdvancedSynthesisandCatalysis,2010,vol.352,#11-12,p.2041-2049

[1]Patent:WO2016/81918,2016,A1,.Locationinpatent:Paragraph00292

[2]Patent:WO2017/205684,2017,A1,.Locationinpatent:Paragraph00706

[1]Patent:WO2006/74281,2006,A2,.Locationinpatent:Page/Pagecolumn42

[1]JournaloftheAmericanChemicalSociety,1986,vol.108,#17,p.5229-5236

Downstream Synthesis Route
23170-45-8   
1-Amino-5-methylpyrazol-4-carbonsaeure-methylester 
 
1-Amino-3-methyl-1H-pyrazole-4-carboxylicacidmethylester 

[1]LiebigsAnnalenderChemie,1993,p.367-374

[1]JournaloftheAmericanChemicalSociety,1986,vol.108,p.5229-5236

23170-45-8   
4-Methyl-1,2,3triazine-5-carboxylicacidmethylester 

[1]LiebigsAnnalenderChemie,1993,p.367-374

Literature
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SDS
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