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Home Carboxys 5-Fluoroindole-2-carboxylic acid

5-Fluoroindole-2-carboxylic acid

CAS No.:
399-76-8
Catalog Number:
AG003MRN
Molecular Formula:
C9H6FNO2
Molecular Weight:
179.1478
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$75
- +
25g
98%
In Stock USA
United States
$300
- +
100g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG003MRN
Chemical Name:
5-Fluoroindole-2-carboxylic acid
CAS Number:
399-76-8
Molecular Formula:
C9H6FNO2
Molecular Weight:
179.1478
MDL Number:
MFCD00005612
IUPAC Name:
5-fluoro-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C9H6FNO2/c10-6-1-2-7-5(3-6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13)
InChI Key:
WTXBRZCVLDTWLP-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)cc([nH]2)C(=O)O
EC Number:
206-919-5
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.038g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
179.15g/mol
Monoisotopic Mass:
179.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Thieno[3,2-d]pyrimidin-4(3H)-one derivatives as PDK1 inhibitors discovered by fragment-based screening. Bioorganic & medicinal chemistry letters 20120615
Genetic mapping of targets mediating differential chemical phenotypes in Plasmodium falciparum. Nature chemical biology 20091001
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Non-peptidic small-molecule inhibitors of the single-chain hepatitis C virus NS3 protease/NS4A cofactor complex discovered by structure-based NMR screening. Journal of medicinal chemistry 20040506
Sustained ER Ca2+ depletion suppresses protein synthesis and induces activation-enhanced cell death in mast cells. The Journal of biological chemistry 20020419
Properties