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79-95-8 | Tetrachlorobisphenol A , 98%
CAS No: 79-95-8 Catalog No: AG003UNA MDL No:MFCD00002178
Product Description
Catalog Number:
AG003UNA
Chemical Name:
Tetrachlorobisphenol A , 98%
CAS Number:
79-95-8
MDL Number:
MFCD00002178
IUPAC Name:
2,6-dichloro-4-[2-(3,5-dichloro-4-hydroxyphenyl)propan-2-yl]phenol
InChI:
InChI=1S/C15H12Cl4O2/c1-15(2,7-3-9(16)13(20)10(17)4-7)8-5-11(18)14(21)12(19)6-8/h3-6,20-21H,1-2H3
InChI Key:
KYPYTERUKNKOLP-UHFFFAOYSA-N
EC Number:
201-237-4
UNII:
FO0P9ET4BN
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.956g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
366.059g/mol
Monoisotopic Mass:
363.959g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
Literature
| Title | Journal |
|---|---|
| Bisphenol A and its derivatives decrease expression of chemerin, which reverses its stimulatory action in ovarian cancer cells. | Toxicology letters 20180701 |
| Estrogenicity of halogenated bisphenol A: in vitro and in silico investigations. | Archives of toxicology 20180301 |
| Agonistic effects of diverse xenobiotics on the constitutive androstane receptor as detected in a recombinant yeast-cell assay. | Toxicology in vitro : an international journal published in association with BIBRA 20180201 |
| Bisphenol AF and Bisphenol B Exert Higher Estrogenic Effects than Bisphenol A via G Protein-Coupled Estrogen Receptor Pathway. | Environmental science & technology 20171003 |
| Different effects of bisphenol a and its halogenated derivatives on the reproduction and development of Oryzias melastigma under environmentally relevant doses. | The Science of the total environment 20171001 |
| Activation of Peroxisome Proliferator-Activated Receptor Gamma and Disruption of Progesterone Synthesis of 2-Ethylhexyl Diphenyl Phosphate in Human Placental Choriocarcinoma Cells: Comparison with Triphenyl Phosphate. | Environmental science & technology 20170404 |
| Bisphenol A and its derivatives tetrabromobisphenol A and tetrachlorobisphenol A induce apelin expression and secretion in ovarian cancer cells through a peroxisome proliferator-activated receptor gamma-dependent mechanism. | Toxicology letters 20170305 |
| Chlorination by-products of bisphenol A enhanced retinoid X receptor disrupting effects. | Journal of hazardous materials 20161215 |
| Predicting anti-androgenic activity of bisphenols using molecular docking and quantitative structure-activity relationships. | Chemosphere 20161101 |
| Bisphenol A and Related Alkylphenols Exert Nongenomic Estrogenic Actions Through a G Protein-Coupled Estrogen Receptor 1 (Gper)/Epidermal Growth Factor Receptor (Egfr) Pathway to Inhibit Meiotic Maturation of Zebrafish Oocytes. | Biology of reproduction 20151201 |
| Activation of Human Peroxisome Proliferator-Activated Nuclear Receptors (PPARγ1) by Semi-Volatile Compounds (SVOCs) and Chemical Mixtures in Indoor Dust. | Environmental science & technology 20150818 |
| Characterizing the peroxisome proliferator-activated receptor (PPARγ) ligand binding potential of several major flame retardants, their metabolites, and chemical mixtures in house dust. | Environmental health perspectives 20150201 |
| Halogenated bisphenol-A analogs act as obesogens in zebrafish larvae (Danio rerio). | Toxicological sciences : an official journal of the Society of Toxicology 20140501 |
| PBDE: structure-activity studies for the inhibition of hepatitis C virus NS3 helicase. | Molecules (Basel, Switzerland) 20140402 |
| In vitro study on the agonistic and antagonistic activities of bisphenol-S and other bisphenol-A congeners and derivatives via nuclear receptors. | Toxicology and applied pharmacology 20131001 |
| Mimicking of estradiol binding by flame retardants and their metabolites: a crystallographic analysis. | Environmental health perspectives 20131001 |
| Peroxisome proliferator-activated receptor γ is a target for halogenated analogs of bisphenol A. | Environmental health perspectives 20110901 |
| Warm reception? Halogenated BPA flame retardants and PPARγ activation. | Environmental health perspectives 20110901 |
| Characterization of novel ligands of ERα, Erβ, and PPARγ: the case of halogenated bisphenol A and their conjugated metabolites. | Toxicological sciences : an official journal of the Society of Toxicology 20110801 |
| Biodegradation of bisphenols with immobilized laccase or tyrosinase on polyacrylonitrile beads. | Biodegradation 20110601 |
| Anti-thyroid hormone activity of bisphenol A, tetrabromobisphenol A and tetrachlorobisphenol A in an improved reporter gene assay. | Toxicology in vitro : an international journal published in association with BIBRA 20090801 |
| Determination of tetrabromobisphenol-A, tetrachlorobisphenol-A and bisphenol-A in soil by ultrasonic assisted extraction and gas chromatography-mass spectrometry. | Journal of chromatography. A 20090717 |
| A standardized method for assessment of oxidative transformations of brominated phenols in water. | Chemosphere 20080101 |
| A new bioluminescent cellular assay to measure the transcriptional effects of chemicals that modulate the alpha-1 thyroid hormone receptor. | Toxicology in vitro : an international journal published in association with BIBRA 20070901 |
| Bisphenol-A and chlorinated derivatives in adipose tissue of women. | Reproductive toxicology (Elmsford, N.Y.) 20070101 |
| Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. | Journal of molecular graphics & modelling 20061101 |
| Effect of bisphenol A, tetrachlorobisphenol A and pentachlorophenol on the transcriptional activities of androgen receptor-mediated reporter gene. | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20061101 |
| Biosensor recognition of thyroid-disrupting chemicals using transport proteins. | Analytical chemistry 20060215 |
| Simultaneous determination of tetrabromobisphenol A, tetrachlorobisphenol A, bisphenol A and other halogenated analogues in sediment and sludge by high performance liquid chromatography-electrospray tandem mass spectrometry. | Journal of chromatography. A 20051202 |
| Inhibitory effects of environmental chemicals on protein disulfide isomerase in vitro. | Osaka city medical journal 20051201 |
| In vitro and in vivo analysis of the thyroid disrupting activities of phenolic and phenol compounds in Xenopus laevis. | Toxicological sciences : an official journal of the Society of Toxicology 20050301 |
| Anti-thyroid hormonal activity of tetrabromobisphenol A, a flame retardant, and related compounds: Affinity to the mammalian thyroid hormone receptor, and effect on tadpole metamorphosis. | Life sciences 20050218 |
| Effects of the environmental oestrogens bisphenol A, tetrachlorobisphenol A, tetrabromobisphenol A, 4-hydroxybiphenyl and 4,4'-dihydroxybiphenyl on oestrogen receptor binding, cell proliferation and regulation of oestrogen sensitive proteins in the human breast cancer cell line MCF-7. | Pharmacology & toxicology 20030401 |
| Thyroid hormonal activity of the flame retardants tetrabromobisphenol A and tetrachlorobisphenol A. | Biochemical and biophysical research communications 20020426 |
| Anaerobic biotransformation of tetrabromobisphenol A, tetrachlorobisphenol A, and bisphenol A in estuarine sediments. | Environmental science & technology 20020215 |
| 2,2',6,6'-Tetrachloro-4,4'-propane-2,2-diyldiphenol, 2,2',6-tribromo-4,4'-propane-2,2-diyldiphenol and 2,2',6,6'-tetrabromo-4,4'-propane-2,2-diyldiphenol. | Acta crystallographica. Section C, Crystal structure communications 20011101 |
| Potent competitive interactions of some brominated flame retardants and related compounds with human transthyretin in vitro. | Toxicological sciences : an official journal of the Society of Toxicology 20000701 |
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