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258273-31-3,MFCD09271830
Catalog No.:AA00BDDI

258273-31-3 | 3-Cyano-4-isopropoxybenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$6.00   $4.00
- +
1g
98%
in stock  
$13.00   $9.00
- +
5g
98%
in stock  
$16.00   $11.00
- +
10g
98%
in stock  
$27.00   $19.00
- +
100g
98%
in stock  
$262.00   $184.00
- +
  • 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:
AA00BDDI
Chemical Name:
3-Cyano-4-isopropoxybenzoic acid
CAS Number:
258273-31-3
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD09271830
SMILES:
N#Cc1cc(ccc1OC(C)C)C(=O)O
Properties
Computed Properties
 
Complexity:
279  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.9  

Upstream Synthesis Route

[1]Patent:US2010/249071,2010,A1,.Locationinpatent:Page/Pagecolumn60-61

[2]Patent:WO2017/4608,2017,A1,.Locationinpatent:Paragraph0159

[3]Patent:WO2005/107762,2005,A2,.Locationinpatent:Page/Pagecolumn194-220

[4]Patent:WO2007/56056,2007,A2,.Locationinpatent:Page/Pagecolumn53

[5]Patent:WO2005/58848,2005,A1,.Locationinpatent:Page/Pagecolumn47

[6]Patent:WO2011/72488,2011,A1,.Locationinpatent:Page/Pagecolumn16;27

[7]Patent:US2012/283297,2012,A1,.Locationinpatent:Page/Pagecolumn18

[8]Patent:WO2016/164180,2016,A1,.Locationinpatent:Paragraph0144

[9]Patent:CN106674044,2017,A,.Locationinpatent:Paragraph0022

[1]Patent:WO2011/5290,2011,A1,.Locationinpatent:Page/Pagecolumn52

[2]Patent:WO2011/72488,2011,A1,.Locationinpatent:Page/Pagecolumn16;28

[3]Patent:US2012/283297,2012,A1,.Locationinpatent:Page/Pagecolumn18

[1]Patent:WO2011/72488,2011,A1,

[2]Patent:US2012/283297,2012,A1,

[3]Patent:WO2017/4608,2017,A1,

[4]Patent:CN106674044,2017,A,

[1]Patent:WO2011/5290,2011,A1,

[2]Patent:WO2011/72488,2011,A1,

[3]Patent:US2012/283297,2012,A1,

[1]Patent:WO2011/72488,2011,A1,

[2]Patent:US2012/283297,2012,A1,

[3]Patent:WO2017/4608,2017,A1,

Downstream Synthesis Route

[1]Patent:US2010/249071,2010,A1.Locationinpatent:Page/Pagecolumn60-61

[2]Patent:WO2017/4608,2017,A1.Locationinpatent:Paragraph0159

[3]Patent:WO2005/107762,2005,A2.Locationinpatent:Page/Pagecolumn194-220

[4]Patent:WO2007/56056,2007,A2.Locationinpatent:Page/Pagecolumn53

[5]Patent:WO2005/58848,2005,A1.Locationinpatent:Page/Pagecolumn47

[6]Patent:WO2011/72488,2011,A1.Locationinpatent:Page/Pagecolumn16;27

[7]Patent:US2012/283297,2012,A1.Locationinpatent:Page/Pagecolumn18

[8]Patent:WO2016/164180,2016,A1.Locationinpatent:Paragraph0144

[9]Patent:CN106674044,2017,A.Locationinpatent:Paragraph0022

[1]CurrentPatentAssignee:PFIZERINC-WO2011/5290,2011,A1

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2011/72488,2011,A1

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US2012/283297,2012,A1

[1]Patent:WO2011/59784,2011,A1.Locationinpatent:Page/Pagecolumn142

[1]Patent:WO2011/72488,2011,A1

[2]Patent:WO2016/164180,2016,A1

[3]Patent:WO2017/4608,2017,A1

[1]Patent:WO2011/72488,2011,A1

[2]Patent:US2012/283297,2012,A1

[3]Patent:WO2016/164180,2016,A1

Literature
Quotation Request
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SDS
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