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101861-63-6,MFCD00209870
Catalog No.:AA0005PT

101861-63-6 | 4,6-Dichloro-1h-indole-2-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$12.00   $8.00
- +
250mg
95%
in stock  
$16.00   $11.00
- +
1g
95%
in stock  
$50.00   $35.00
- +
5g
95%
in stock  
$214.00   $150.00
- +
25g
95%
in stock  
$762.00   $534.00
- +
100g
96%
in stock  
$2,007.00   $1,405.00
- +
  • 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:
AA0005PT
Chemical Name:
4,6-Dichloro-1h-indole-2-carboxylic acid
CAS Number:
101861-63-6
Molecular Formula:
C9H5Cl2NO2
Molecular Weight:
230.0475
MDL Number:
MFCD00209870
SMILES:
Clc1cc(Cl)c2c(c1)[nH]c(c2)C(=O)O
Properties
Computed Properties
 
Complexity:
249  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
3.2  

Upstream Synthesis Route

[1]GazzettaChimicaItaliana,1958,vol.88,p.1147,1153,1159

[1]Patent:WO2014/37900,2014,A1,.Locationinpatent:Paragraph27;28

[2]GazzettaChimicaItaliana,1958,vol.88,p.1147,1153,1159

[3]JournalofMedicinalChemistry,1990,vol.33,#11,p.2944-2946

[1]Patent:WO2014/37900,2014,A1,

[1]Patent:WO2014/37900,2014,A1,

[1]Patent:WO2014/37900,2014,A1,

Downstream Synthesis Route

[1]GazzettaChimicaItaliana,1958,vol.88,p.1147,1153,1159

[2]Patent:CN109160895,2019,A.Locationinpatent:Paragraph0046-0048;0049-0051;0052-0054

[1]Patent:WO2014/37900,2014,A1.Locationinpatent:Paragraph27;28

[2]Patent:WO2019/46318,2019,A1.Locationinpatent:Paragraph00219;00220

[3]GazzettaChimicaItaliana,1958,vol.88,p.1147,1153,1159

[4]JournalofMedicinalChemistry,1990,vol.33,p.2944-2946

[5]Patent:CN109160895,2019,A.Locationinpatent:Paragraph0038-0039;0041-0042;0043-0045

101861-63-6   
1-carbamoyl-2-(1<i>H</i>-indol-3-yl)-ethyl-carbamicacid9<i>H</i>-fluoren-9-ylmethylester 
  237394-58-0   
{2-1-carbamoyl-2-(1<i>H</i>-indol-3-yl)-ethylcarbamoyl-5-phenyl-pentyl}-{1-(4,6-dichloro-1<i>H</i>-indole-2-carbonyl)-amino-2-phenyl-ethyl}-phosphinicacid 

[1]JournalofMedicinalChemistry,1999,vol.42,p.2610-2620

[1]EuropeanJournalofMedicinalChemistry,2003,vol.38,p.855-865

[1]EuropeanJournalofMedicinalChemistry,2003,vol.38,p.855-865

Literature

Title: 3-(2-carboxyethyl)-4,6-dichloro-1H-indole-2-carboxylic acid: an allosteric inhibitor of fructose-1,6-bisphosphatase at the AMP site.

Journal: Bioorganic & medicinal chemistry letters 20030616

Title: Hydantoin-substituted 4,6-dichloroindole-2-carboxylic acids as ligands with high affinity for the glycine binding site of the NMDA receptor.

Journal: Journal of medicinal chemistry 20030102

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SDS
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Tags:101861-63-6 Molecular Formula|101861-63-6 MDL|101861-63-6 SMILES|101861-63-6 4,6-Dichloro-1h-indole-2-carboxylic acid