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843-55-0,MFCD00019341
Catalog No.:AA003AWO

843-55-0 | 1,1-Bis(4-hydroxyphenyl)cyclohexane

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5g
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25g
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003AWO
Chemical Name:
1,1-Bis(4-hydroxyphenyl)cyclohexane
CAS Number:
843-55-0
Molecular Formula:
C18H20O2
Molecular Weight:
268.3502
MDL Number:
MFCD00019341
SMILES:
Oc1ccc(cc1)C1(CCCCC1)c1ccc(cc1)O
Properties
Properties
 
BP:
440.9 °C at 760 mmHg  
Form:
Solid  
MP:
190-192 °C(lit.)  
Refractive Index:
1.5490 (estimate)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
269  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
5.4  

Downstream Synthesis Route

[1]YukiGoseiKagakuKyokaishi,1951,vol.9,p.20,23    Chem.Abstr.,1953,p.815

[2]OrientalJournalofChemistry,2011,vol.27,p.1699-1704

[1]Patent:US2118954,1936,

[2]ChemischeBerichte,1931,vol.64,p.2621,2624

[1]Patent:US2342294,1940,

[2]Patent:US2342294,1940,

[1]JournaloftheAmericanChemicalSociety,1944,vol.66,p.967

[1]JustusLiebigsAnnalenderChemie,1929,vol.472,p.34

Literature

Title: Agonistic effects of diverse xenobiotics on the constitutive androstane receptor as detected in a recombinant yeast-cell assay.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20180201

Title: Editor's Highlight: Transcriptome Profiling Reveals Bisphenol A Alternatives Activate Estrogen Receptor Alpha in Human Breast Cancer Cells.

Journal: Toxicological sciences : an official journal of the Society of Toxicology 20170801

Title: Thyroid hormone disrupting potentials of bisphenol A and its analogues - in vitro comparison study employing rat pituitary (GH3) and thyroid follicular (FRTL-5) cells.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20170401

Title: In vitro and in silico assessment of the structure-dependent binding of bisphenol analogues to glucocorticoid receptor.

Journal: Analytical and bioanalytical chemistry 20170301

Title: Predicting anti-androgenic activity of bisphenols using molecular docking and quantitative structure-activity relationships.

Journal: Chemosphere 20161101

Title: Defining estrogenic mechanisms of bisphenol A analogs through high throughput microscopy-based contextual assays.

Journal: Chemistry & biology 20140619

Title: Structure-activity relationships of bisphenol A analogs at estrogen receptors (ERs): discovery of an ERα-selective antagonist.

Journal: Bioorganic & medicinal chemistry letters 20130715

Title: Bioactivation of bisphenol A and its analogs (BPF, BPAF, BPZ and DMBPA) in human liver microsomes.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20130601

Title: Occurrence of eight bisphenol analogues in indoor dust from the United States and several Asian countries: implications for human exposure.

Journal: Environmental science & technology 20120821

Title: Stir bar sorptive extraction coupled to gas chromatography-mass spectrometry for the determination of bisphenols in canned beverages and filling liquids of canned vegetables.

Journal: Journal of chromatography. A 20120720

Title: Comparison of endocrine-mediated effects of two bisphenol A related compounds, 2,2-bis(4-cyanatophyenyl)propane and 4,4'-cyclohexylidenebisphenol, based on subacute oral toxicity studies using rats.

Journal: Toxicology letters 20120125

Title: 1-Benzyl-2-phenyl-1H-benzimidazole-4,4'-(cyclo-hexane-1,1-di-yl)diphenol (1/1).

Journal: Acta crystallographica. Section E, Structure reports online 20110701

Title: Rational quantitative structure-activity relationship (RQSAR) screen for PXR and CAR isoform-specific nuclear receptor ligands.

Journal: Chemico-biological interactions 20101205

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: 4,4'-(Cyclo-hexane-1,1-di-yl)diphenol methanol solvate.

Journal: Acta crystallographica. Section E, Structure reports online 20090201

Title: Inclusion of chlorophenols by 4,4'-(cyclohexane-1,1-diyl)diphenol: structures and kinetics of decomposition.

Journal: Acta crystallographica. Section C, Crystal structure communications 20070601

Title: Photodegradation of bisphenol Z by UV irradiation in the presence of beta-cyclodextrin.

Journal: Chemosphere 20070301

Title: Biodegradation of bisphenol A and related compounds by Sphingomonas sp. strain BP-7 isolated from seawater.

Journal: Bioscience, biotechnology, and biochemistry 20070101

Title: Synthesis and structural characterisation as 12-helix of the hexamer of a beta-amino acid tethered to a pyrrolidin-2-one ring.

Journal: Chemical communications (Cambridge, England) 20061221

Title: Polymorphs of 1,1-bis(4-hydroxyphenyl)cyclohexane and multiple Z' crystal structures by melt and sublimation crystallization.

Journal: Chemical communications (Cambridge, England) 20061221

Title: Comparative study of the uterotrophic potency of 14 chemicals in a uterotrophic assay and their receptor-binding affinity.

Journal: Toxicology letters 20040115

Title: Inclusion compounds of a diol host with xylidines: controlled stoichiometries.

Journal: Acta crystallographica. Section B, Structural science 20020401

Title: Simultaneous determination of phenolic xenoestrogens by solid-phase extraction and high-performance liquid chromatography with fluorescence detection.

Journal: Analytical sciences : the international journal of the Japan Society for Analytical Chemistry 20010601

Title: Measurement of estrogenic activity of chemicals for the development of new dental polymers.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20010101

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