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Home Bromides 400071-95-6
400071-95-6,MFCD14706162
Catalog No.:AA00C8JU

400071-95-6 | 5-Bromo-1-methyl-1h-indole-3-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$13.00   $9.00
- +
250mg
97%
in stock  
$16.00   $11.00
- +
1g
97%
in stock  
$52.00   $36.00
- +
  • 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:
AA00C8JU
Chemical Name:
5-Bromo-1-methyl-1h-indole-3-carboxylic acid
CAS Number:
400071-95-6
Molecular Formula:
C10H8BrNO2
Molecular Weight:
254.0800
MDL Number:
MFCD14706162
SMILES:
Brc1ccc2c(c1)c(cn2C)C(=O)O
Properties
Properties
 
Form:
Solid  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
246  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.2  

Upstream Synthesis Route

[1]Tetrahedron,2016,vol.72,#5,p.734-745

[1]Patent:EP2548864,2013,A1,.Locationinpatent:Paragraph0325;0326

[2]Patent:WO2013/14102,2013,A1,.Locationinpatent:Page/Pagecolumn64;65;66

[1]EuropeanJournalofMedicinalChemistry,2001,vol.36,#6,p.545-553

[1]EuropeanJournalofMedicinalChemistry,2001,vol.36,#6,p.545-553

[2]Patent:EP2548864,2013,A1,

[3]Patent:WO2013/14102,2013,A1,

[4]Tetrahedron,2016,vol.72,#5,p.734-745

[1]EuropeanJournalofMedicinalChemistry,2001,vol.36,#6,p.545-553

Downstream Synthesis Route
504-24-5    400071-95-6   
5-bromo-1-methyl-1<i>H</i>-indole-3-carboxylicacidpyridin-4-ylamide 

[1]EuropeanJournalofMedicinalChemistry,2001,vol.36,p.545-553

[1]EuropeanJournalofMedicinalChemistry,2001,vol.36,p.545-553

[2]OrganicLetters,2019,vol.21,p.2048-2051

5407-87-4    400071-95-6   
5-bromo-1-methyl-1<i>H</i>-indole-3-carboxylicacid(4,6-dimethyl-pyridin-2-yl)-amide 

[1]EuropeanJournalofMedicinalChemistry,2001,vol.36,p.545-553

[1]EuropeanJournalofMedicinalChemistry,2001,vol.36,p.545-553

[2]Patent:EP2548864,2013,A1

[3]Patent:WO2013/14102,2013,A1

[4]Tetrahedron,2016,vol.72,p.734-745

[1]EuropeanJournalofMedicinalChemistry,2001,vol.36,p.545-553

[2]OrganicLetters,2019,vol.21,p.2048-2051

Literature
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SDS
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