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Home Carboxys 7-Nitroindole-2-carboxylic acid

7-Nitroindole-2-carboxylic acid

CAS No.:
6960-45-8
Catalog Number:
AG003NGS
Molecular Formula:
C9H6N2O4
Molecular Weight:
206.1549
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$82
- +
5g
95%
In Stock USA
United States
$276
- +
25g
95%
In Stock USA
United States
$1214
- +
Product Description
Catalog Number:
AG003NGS
Chemical Name:
7-Nitroindole-2-carboxylic acid
CAS Number:
6960-45-8
Molecular Formula:
C9H6N2O4
Molecular Weight:
206.1549
MDL Number:
MFCD00044720
IUPAC Name:
7-nitro-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C9H6N2O4/c12-9(13)6-4-5-2-1-3-7(11(14)15)8(5)10-6/h1-4,10H,(H,12,13)
InChI Key:
BIUCOFQROHIAEO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1[nH]c(c2)C(=O)O
EC Number:
230-154-6
NSC Number:
69877
Properties
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.033g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.157g/mol
Monoisotopic Mass:
206.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
98.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Synthesis, biological evaluation, and structure-activity relationships of a novel class of apurinic/apyrimidinic endonuclease 1 inhibitors. Journal of medicinal chemistry 20120412
Lucanthone and its derivative hycanthone inhibit apurinic endonuclease-1 (APE1) by direct protein binding. PloS one 20110101
Genome-wide reprogramming in the mouse germ line entails the base excision repair pathway. Science (New York, N.Y.) 20100702
Cross-talk-free dual-color fluorescence cross-correlation spectroscopy for the study of enzyme activity. Analytical chemistry 20100215
Radiation resistance in glioma cells determined by DNA damage repair activity of Ape1/Ref-1. Journal of radiation research 20100101
Identification and characterization of inhibitors of human apurinic/apyrimidinic endonuclease APE1. PloS one 20090101
Properties