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Home Other Building Blocks 2-Aminoanthraquinone

2-Aminoanthraquinone

CAS No.:
117-79-3
Catalog Number:
AG000DI8
Molecular Formula:
C14H9NO2
Molecular Weight:
223.2268
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
80%
In Stock USA
United States
$13
- +
25g
80%
In Stock USA
United States
$25
- +
100g
80%
In Stock USA
United States
$75
- +
Product Description
Catalog Number:
AG000DI8
Chemical Name:
2-Aminoanthraquinone
CAS Number:
117-79-3
Molecular Formula:
C14H9NO2
Molecular Weight:
223.2268
MDL Number:
MFCD00001233
IUPAC Name:
2-aminoanthracene-9,10-dione
InChI:
InChI=1S/C14H9NO2/c15-8-5-6-11-12(7-8)14(17)10-4-2-1-3-9(10)13(11)16/h1-7H,15H2
InChI Key:
XOGPDSATLSAZEK-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)C(=O)c1c(C2=O)cccc1
EC Number:
204-208-4
UNII:
65Z03V2Z09
NSC Number:
5
RTECS Number:
CB5120000
Properties
Complexity:
352  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.063g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.231g/mol
Monoisotopic Mass:
223.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
High-performance supercapacitor electrodes based on graphene hydrogels modified with 2-aminoanthraquinone moieties. Physical chemistry chemical physics : PCCP 20110621
2-Aminoanthraquinone. Report on carcinogens : carcinogen profiles 20110101
Estrogenic activity of anthraquinone derivatives: in vitro and in silico studies. Chemical research in toxicology 20100816
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. Journal of molecular graphics & modelling 20061101
Photophysical properties of 2-amino-9,10-anthraquinone: evidence for structural changes in the molecule with solvent polarity. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20050101
Influence of functional group substitutions on the carcinogenicity of anthraquinone in rats and mice: analysis of long-term bioassays by the National Cancer Institute and the National Toxicology Program. Journal of toxicology and environmental health. Part B, Critical reviews 20050101
2-Aminoanthraquinone. Report on carcinogens : carcinogen profiles 20040101
2-Aminoanthraquinone. Report on carcinogens : carcinogen profiles 20020101
Bioassay of 2-aminoanthraquinone for possible carcinogenicity. National Cancer Institute carcinogenesis technical report series 19780101
Properties