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Home Carboxes 1105039-93-7
1105039-93-7,MFCD08456928
Catalog No.:AA0093NT

1105039-93-7 | 1-(4-Methoxybenzyl)-1h-pyrazole-4-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$11.00   $8.00
- +
1g
97%
in stock  
$34.00   $24.00
- +
  • 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:
AA0093NT
Chemical Name:
1-(4-Methoxybenzyl)-1h-pyrazole-4-carboxylic acid
CAS Number:
1105039-93-7
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
MDL Number:
MFCD08456928
SMILES:
COc1ccc(cc1)Cn1ncc(c1)C(=O)O
Properties
Computed Properties
 
Complexity:
265  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
1.3  

Upstream Synthesis Route

[1]Patent:US2012/35168,2012,A1,.Locationinpatent:Page/Pagecolumn36

[1]JournalofLabelledCompoundsandRadiopharmaceuticals,2015,vol.58,#9,p.390-394

[1]Patent:WO2011/86163,2011,A1,

[2]Patent:WO2012/9001,2012,A2,

[3]Patent:WO2013/107862,2013,A1,

[4]Patent:US2014/349994,2014,A1,

[5]JournalofLabelledCompoundsandRadiopharmaceuticals,2015,vol.58,#9,p.390-394

[6]Patent:US2017/240552,2017,A1,

[1]Patent:US2015/368244,2015,A1,

[2]Patent:WO2009/151589,2009,A1,

Downstream Synthesis Route
1105039-93-7   
1-(4-methoxybenzyl)-1H-pyrazole-4-carbonylchloride 

[1]Patent:US2017/240552,2017,A1.Locationinpatent:Paragraph0193;0194

[2]Patent:US2015/368244,2015,A1.Locationinpatent:Paragraph0253;0254

[3]Patent:WO2009/151589,2009,A1.Locationinpatent:Page/Pagecolumn59

[4]Patent:WO2009/10455,2009,A2.Locationinpatent:Page/Pagecolumn53

[5]Patent:WO2011/86163,2011,A1.Locationinpatent:Page/Pagecolumn25-26

[6]Patent:WO2013/107862,2013,A1.Locationinpatent:Page/Pagecolumn54

1-(4-methoxybenzyl)-1H-pyrazole-4-carboxylicacidethylester 
  1105039-93-7 

[1]Patent:US2015/368244,2015,A1.Locationinpatent:Paragraph0251;0252

[2]Patent:WO2009/151589,2009,A1.Locationinpatent:Page/Pagecolumn59

[3]Patent:WO2012/9001,2012,A2.Locationinpatent:Page/Pagecolumn36

[4]Patent:WO2013/107862,2013,A1.Locationinpatent:Page/Pagecolumn54

[5]Patent:US2014/349994,2014,A1.Locationinpatent:Paragraph0518;0519

[6]Patent:WO2011/86163,2011,A1.Locationinpatent:Page/Pagecolumn25

[7]Patent:US2017/240552,2017,A1.Locationinpatent:Paragraph0187;0188;0189;0190;0191;0192

1105039-93-7   
C12H11ClN2O2*(x)ClH 

[1]Patent:US2010/144756,2010,A1.Locationinpatent:Page/Pagecolumn22

[1]Patent:WO2010/79239,2010,A1.Locationinpatent:Page/Pagecolumn44

[2]Patent:WO2012/9001,2012,A2.Locationinpatent:Page/Pagecolumn36

[3]Patent:US2014/349994,2014,A1.Locationinpatent:Paragraph0520;0521

[1]Patent:WO2010/79239,2010,A1.Locationinpatent:Page/Pagecolumn56

Literature
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SDS
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Tags:1105039-93-7 Molecular Formula|1105039-93-7 MDL|1105039-93-7 SMILES|1105039-93-7 1-(4-Methoxybenzyl)-1h-pyrazole-4-carboxylic acid