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27746-03-8,MFCD07343826
Catalog No.:AA002UKJ

27746-03-8 | 4-Chloro-1h-pyrrole-2-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
96%
in stock  
$17.00   $12.00
- +
250mg
96%
in stock  
$24.00   $17.00
- +
1g
96%
in stock  
$87.00   $61.00
- +
10g
96%
in stock  
$834.00   $584.00
- +
25g
96%
in stock  
$2,004.00   $1,403.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002UKJ
Chemical Name:
4-Chloro-1h-pyrrole-2-carboxylic acid
CAS Number:
27746-03-8
Molecular Formula:
C5H4ClNO2
Molecular Weight:
145.5438
MDL Number:
MFCD07343826
SMILES:
OC(=O)c1cc(c[nH]1)Cl
Properties
Properties
 
BP:
361.9°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
128  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1.2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ISTITUTODIRICERCHEDIBIOLOGIAMOLECOLAREP.ANGELETTIS.R.L.-WO2007/138355,2007,A1Locationinpatent:Page/Pagecolumn84

[1]CurrentPatentAssignee:ADDEXTHERAPEUTICSSA-WO2006/123257,2006,A2Locationinpatent:Page/Pagecolumn58

[2]CurrentPatentAssignee:UNIVHUAQIAO-CN114456099,2022,ALocationinpatent:Paragraph0040;0042;0044-0046;0048-0049;0051-0052;...

[3]Locationinpatent:experimentalpartClark,BenjaminR.;Murphy,CormacD.[OrganicandBiomolecularChemistry,2009,vol.7,#1,p.111-116]

[1]CurrentPatentAssignee:ADDEXTHERAPEUTICSSA-WO2006/123257,2006,A2Locationinpatent:Page/Pagecolumn58-59

[1]CurrentPatentAssignee:MERCK&COINC-WO2010/124055,2010,A1Locationinpatent:Page/Pagecolumn45

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Virtual fragment screening for novel inhibitors of 6-phosphogluconate dehydrogenase.

Journal: Bioorganic & medicinal chemistry 20100715

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SDS
Tags:27746-03-8 Molecular Formula|27746-03-8 MDL|27746-03-8 SMILES|27746-03-8 4-Chloro-1h-pyrrole-2-carboxylic acid