Home Halogens 1-amino-2,4-dibromoanthraquinone

1-amino-2,4-dibromoanthraquinone

CAS No.:
81-49-2
Catalog Number:
AG0036LA
Molecular Formula:
C14H7Br2NO2
Molecular Weight:
381.0189
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG0036LA
Chemical Name:
1-amino-2,4-dibromoanthraquinone
CAS Number:
81-49-2
Molecular Formula:
C14H7Br2NO2
Molecular Weight:
381.0189
MDL Number:
MFCD00019155
IUPAC Name:
1-amino-2,4-dibromoanthracene-9,10-dione
InChI:
InChI=1S/C14H7Br2NO2/c15-8-5-9(16)12(17)11-10(8)13(18)6-3-1-2-4-7(6)14(11)19/h1-5H,17H2
InChI Key:
ZINRVIQBCHAZMM-UHFFFAOYSA-N
SMILES:
Brc1cc(Br)c(c2c1C(=O)c1ccccc1C2=O)N
EC Number:
201-354-0
UNII:
RF75O3IKOZ
NSC Number:
3529
Properties
Complexity:
414  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.882g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
381.023g/mol
Monoisotopic Mass:
378.884g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Literature
Title Journal
Investigation of the early-response genes in chemical-induced renal carcinogenicity for the prediction of chemical carcinogenicity in rats. The Journal of toxicological sciences 20170101
1-Amino-2,4-dibromoanthraquinone. Report on carcinogens : carcinogen profiles 20110101
Estrogenic activity of anthraquinone derivatives: in vitro and in silico studies. Chemical research in toxicology 20100816
Combined experimental and theoretical study on photoinduced toxicity of an anthraquinone dye intermediate to Daphnia magna. Environmental toxicology and chemistry 20090401
1-Amino-2,4-dibromoanthraquinone. Report on carcinogens : carcinogen profiles 20040101
Point mutations of K-ras and H-ras genes in forestomach neoplasms from control B6C3F1 mice and following exposure to 1,3-butadiene, isoprene or chloroprene for up to 2-years. Chemico-biological interactions 20010601
High frequency of ras mutations in forestomach and lung tumors of B6C3F1 mice exposed to 1-amino-2,4-dibromoanthraquinone for 2 years. Toxicologic pathology 20010101
NTP Toxicology and Carcinogenesis Studies of 1-Amino-2,4-Dibromoanthraquinone (CAS No. 81-49-2) in F344/N Rats and B6C3F1 Mice (Feed Studies). National Toxicology Program technical report series 19960801
Use of rat liver altered focus models for testing chemicals that have completed two-year carcinogenicity studies. Toxicologic pathology 19890101
Observations on altered hepatocellular foci in National Toxicology Program two-year carcinogenicity studies in rats. Toxicologic pathology 19890101
Thirteen-week toxicology studies of 1-amino-2,4-dibromoanthraquinone in Fischer 344/N rats and B6C3F1 mice. Toxicology and applied pharmacology 19860315
Properties