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Home Indole and Oxindoles 29953-71-7
29953-71-7,MFCD00005633
Catalog No.:AA00I5HV

29953-71-7 | trans 3-Indoleacrylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$47.00   $33.00
- +
5g
95%
in stock  
$115.00   $81.00
- +
25g
95%
in stock  
$409.00   $287.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I5HV
Chemical Name:
trans 3-Indoleacrylic acid
CAS Number:
29953-71-7
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
MDL Number:
MFCD00005633
SMILES:
OC(=O)/C=C/c1c[nH]c2c1cccc2 C11H9NO2
Properties
Properties
 
BP:
432.8°C at 760 mmHg  
Form:
Solid  
MP:
185 °C (dec.)(lit.)  
Refractive Index:
1.4900 (estimate)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
250  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
2.2  

Downstream Synthesis Route
3544-24-9    1204-06-4   
(E)-3-3-(1H-indol-3-yl)acrylamidobenzamide 

[1]AngewandteChemie-InternationalEdition,2012,vol.51,p.12509-12513    Angew.Chem.,2012,vol.124,p.12677-12681,5

[2]Patent:WO2008/39007,2008,A1.Locationinpatent:Page/Pagecolumn23-24

[3]Patent:EP2774918,2014,A1.Locationinpatent:Paragraph0040;0126;0134-0137

Literature

Title: Chemical genetics-based discovery of indole derivatives as HCV NS5B polymerase inhibitors.

Journal: European journal of medicinal chemistry 20140321

Title: A urinary metabonomics study on biochemical changes in yeast-induced pyrexia rats: a new approach to elucidating the biochemical basis of the febrile response.

Journal: Chemico-biological interactions 20130625

Title: Exploration of natural compounds as sources of new bifunctional scaffolds targeting cholinesterases and beta amyloid aggregation: the case of chelerythrine.

Journal: Bioorganic & medicinal chemistry 20121115

Title: Tryptophan 2,3-dioxygenase (TDO) inhibitors. 3-(2-(pyridyl)ethenyl)indoles as potential anticancer immunomodulators.

Journal: Journal of medicinal chemistry 20110811

Title: Cold-adapted and rhizosphere-competent strain of Rahnella sp. with broad-spectrum plant growth-promotion potential.

Journal: Journal of microbiology and biotechnology 20101201

Title: Over-expression of the IGI1 leading to altered shoot-branching development related to MAX pathway in Arabidopsis.

Journal: Plant molecular biology 20100801

Title: Structural insight into the inhibition of human kynurenine aminotransferase I/glutamine transaminase K.

Journal: Journal of medicinal chemistry 20090514

Title: Allosteric regulation of tryptophan synthase channeling: the internal aldimine probed by trans-3-indole-3'-acrylate binding.

Journal: Biochemistry 20070703

Title: Effect of matrix and solvent on the analysis of novel poly(phenylenevinylene) derivatives by matrix-assisted laser desorption/ionization time-of-flight mass spectrometry.

Journal: Rapid communications in mass spectrometry : RCM 20040101

Title: The use of nonpolar matrices for matrix-assisted laser desorption/ionization mass spectrometric analysis of high boiling crude oil fractions.

Journal: Rapid communications in mass spectrometry : RCM 20030101

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SDS
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