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889942-85-2,MFCD07776626
Catalog No.:AA00GUZZ

889942-85-2 | 3-Cyano-1h-indole-4-carboxylic acid

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Purity
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Price(USD)
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1g
98%
in stock  
$261.00   $183.00
- +
5g
98%
in stock  
$677.00   $474.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00GUZZ
Chemical Name:
3-Cyano-1h-indole-4-carboxylic acid
CAS Number:
889942-85-2
Molecular Formula:
C10H6N2O2
Molecular Weight:
186.1668
MDL Number:
MFCD07776626
SMILES:
N#Cc1c[nH]c2c1c(ccc2)C(=O)O
Properties
Computed Properties
 
Complexity:
294  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1.3  

Downstream Synthesis Route

[1]Locationinpatent:schemeortableHeinrich,Timo;Graedler,Ulrich;Boettcher,Henning;Blaukat,Andree;Shutes,Adam[ACSMedicinalChemistryLetters,2010,vol.1,#5,p.199-203]

Literature
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SDS
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Tags:889942-85-2 Molecular Formula|889942-85-2 MDL|889942-85-2 SMILES|889942-85-2 3-Cyano-1h-indole-4-carboxylic acid