Home Carboxes 52531-12-1
52531-12-1,MFCD00127887
Catalog No.:AA00D8M4

52531-12-1 | 5-Ethylindole-3-acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
≥ 95% (HPLC)
in stock  
$250.00   $175.00
- +
1g
≥ 95% (HPLC)
in stock  
$486.00   $341.00
- +
5g
≥ 95% (HPLC)
in stock  
$1,690.00   $1,183.00
- +
10g
≥ 95% (HPLC)
in stock  
$2,656.00   $1,860.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00D8M4
Chemical Name:
5-Ethylindole-3-acetic acid
CAS Number:
52531-12-1
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
MDL Number:
MFCD00127887
SMILES:
CCc1ccc2c(c1)c(c[nH]2)CC(=O)O
Properties
Properties
 
Form:
Solid  
Storage:
2-8℃;Keep in dry area;  

Computed Properties
 
Complexity:
242  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
2.2  

Downstream Synthesis Route
N-(6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl)benzene-1,4-diamine 
  52531-12-1   
2-(5-ethyl-1H-indol-3-yl)-N-(4-((6-methyl-2-(pyrrolidin-1-yl)-pyrimidin-4-yl)amino)phenyl)acetamide 

[1]Abbott,JoshuaM.;Abraham,AdedoyinD.;Awolade,Paul;Esquer,Hector;Gustafson,DanielL.;Kompella,UdayB.;Labarbera,DanielV.;Lai,Xin-He;Matter,Brock;Messersmith,WellsA.;Pike,LauraA.;Prigaro,BrettJ.;Zhou,Qiong[JournalofMedicinalChemistry,2022,vol.65,#5,p.3943-3961]

Literature

Title: Binding of ring-substituted indole-3-acetic acids to human serum albumin.

Journal: Bioorganic & medicinal chemistry 20070701

Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Tags:52531-12-1 Molecular Formula|52531-12-1 MDL|52531-12-1 SMILES|52531-12-1 5-Ethylindole-3-acetic acid