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18711-13-2,MFCD00047214
Catalog No.:AA003KHE

18711-13-2 | 4,7-Dichloroisatin

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$6.00   $4.00
- +
1g
95%
in stock  
$9.00   $7.00
- +
25g
95%
in stock  
$122.00   $86.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003KHE
Chemical Name:
4,7-Dichloroisatin
CAS Number:
18711-13-2
Molecular Formula:
C8H3Cl2NO2
Molecular Weight:
216.0209
MDL Number:
MFCD00047214
SMILES:
Clc1ccc(c2c1C(=O)C(=O)N2)Cl
Properties
Properties
 
BP:
°C at 760 mmHg  
Form:
Solid  
MP:
250-252°C(lit.)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
269  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
XLogP3:
2  

Upstream Synthesis Route

[1]OrganicLetters,2013,vol.15,#14,p.3558-3561

[2]JournalofOrganicChemistry,2014,vol.79,#23,p.11339-11348

[3]JournalofOrganicChemistry,1952,vol.17,p.149,153

[4]JournaloftheAmericanChemicalSociety,1956,vol.78,p.1251,1254

[1]Patent:WO2016/57698,2016,A1,.Locationinpatent:Page/Pagecolumn33

[2]Patent:WO2017/172368,2017,A1,.Locationinpatent:Paragraph0134

Downstream Synthesis Route

[1]OrganicLetters,2013,vol.15,p.3558-3561

[2]JournalofOrganicChemistry,2014,vol.79,p.11339-11348

[3]JournalofOrganicChemistry,1952,vol.17,p.149,153

18711-13-2    91-56-5   
4,7-Dichloro-3-hydroxy-3-(2-oxo-propyl)-1,3-dihydro-indol-2-one 

[1]JournalofPharmaceuticalSciences,1980,vol.69,p.1235-1237

[1]JournalofHeterocyclicChemistry,1984,vol.21,p.1641-1645

18711-13-2    6610-29-3   
6,9-Dichloro-4-methyl-2,4-dihydro-1,2,4triazino5,6-bindole-3-thione 

[1]AgriculturalandBiologicalChemistry,1987,vol.51,p.3177-3178

[1]JournalofHeterocyclicChemistry,1984,vol.21,p.1641-1645

Literature

Title: Selective inhibition of carboxylesterases by isatins, indole-2,3-diones.

Journal: Journal of medicinal chemistry 20070419

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SDS
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Tags:18711-13-2 Molecular Formula|18711-13-2 MDL|18711-13-2 SMILES|18711-13-2 4,7-Dichloroisatin
Catalog No.: AA003KHE
18711-13-2,MFCD00047214
18711-13-2 | 4,7-Dichloroisatin
Pack Size： 250mg
Purity： 95%
in stock
$6.00 $4.00
Pack Size： 1g
Purity： 95%
in stock
$9.00 $7.00
Pack Size： 25g
Purity： 95%
in stock
$122.00 $86.00
Quantity
- +
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Technical Information
Catalog Number: AA003KHE
Chemical Name: 4,7-Dichloroisatin
CAS Number: 18711-13-2
Molecular Formula: C8H3Cl2NO2
Molecular Weight: 216.0209
MDL Number: MFCD00047214
SMILES: Clc1ccc(c2c1C(=O)C(=O)N2)Cl
Properties
BP: °C at 760 mmHg  
Form: Solid  
MP: 250-252°C(lit.)  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 269  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
XLogP3: 2  
Upstream Synthesis Route
18711-13-2    3032-32-4 

[1]OrganicLetters,2013,vol.15,#14,p.3558-3561

[2]JournalofOrganicChemistry,2014,vol.79,#23,p.11339-11348

[3]JournalofOrganicChemistry,1952,vol.17,p.149,153

[4]JournaloftheAmericanChemicalSociety,1956,vol.78,p.1251,1254

18711-13-2    100-06-1    1037184-44-3 

[1]Patent:WO2016/57698,2016,A1,.Locationinpatent:Page/Pagecolumn33

[2]Patent:WO2017/172368,2017,A1,.Locationinpatent:Paragraph0134

Downstream Synthesis Route
18711-13-2    3032-32-4 

[1]OrganicLetters,2013,vol.15,p.3558-3561

[2]JournalofOrganicChemistry,2014,vol.79,p.11339-11348

[3]JournalofOrganicChemistry,1952,vol.17,p.149,153

18711-13-2    91-56-5   
4,7-Dichloro-3-hydroxy-3-(2-oxo-propyl)-1,3-dihydro-indol-2-one 

[1]JournalofPharmaceuticalSciences,1980,vol.69,p.1235-1237

18711-13-2    57-14-7    95060-40-5 

[1]JournalofHeterocyclicChemistry,1984,vol.21,p.1641-1645

18711-13-2    6610-29-3   
6,9-Dichloro-4-methyl-2,4-dihydro-1,2,4triazino5,6-bindole-3-thione 

[1]AgriculturalandBiologicalChemistry,1987,vol.51,p.3177-3178

18711-13-2    60-34-4    95060-58-5 

[1]JournalofHeterocyclicChemistry,1984,vol.21,p.1641-1645

Literature fold

Title: Selective inhibition of carboxylesterases by isatins, indole-2,3-diones.

Journal: Journal of medicinal chemistry20070419

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