2,2-Bis(3,5-difluoro-4-hydroxyphenyl)hexafluoropropane

Base Information

• Chemical Name: 2,2-Bis(3,5-difluoro-4-hydroxyphenyl)hexafluoropropane
• CAS No.: 114611-30-2
• Molecular Formula: C15H6 F10 O2
• Molecular Weight: 408.19
• Hs Code.: 2906290090
• DSSTox Substance ID: DTXSID80371088
• Wikidata: Q82158330
• ChEMBL ID: CHEMBL2392773
• Mol file: 114611-30-2.mol

Synonyms:114611-30-2;2,2-Bis(3,5-difluoro-4-hydroxyphenyl)hexafluoropropane;4-[2-(3,5-difluoro-4-hydroxyphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenol;4,4'-(Perfluoropropane-2,2-diyl)bis(2,6-difluorophenol);2,2-Bis(3,5-difluoro-4-hydroxyphenyl)-hexafluoropropane;SCHEMBL3680776;CHEMBL2392773;DTXSID80371088;MFCD01320803;AKOS015852975;PS-10987;CS-0335254;FT-0609165;A803204;J-003108;? 2,2-Bis(3,5-difluoro-4-hydroxyphenyl)hexafluoropropane;4,4'-(1,1,1,3,3,3-Hexafluoropropane-2,2-diyl)bis(2,6-difluorophenol);Phenol, 4,4'-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]bis[2,6-difluoro-

Chemical Property of 2,2-Bis(3,5-difluoro-4-hydroxyphenyl)hexafluoropropane

Chemical Property:

• Vapor Pressure: 0.00173mmHg at 25°C
• Refractive Index: 1.466
• Boiling Point: 284.5°Cat760mmHg
• PKA: 7.15±0.10(Predicted)
• Flash Point: 125.8°C
• PSA: 40.46000
• Density: 1.638g/cm³
• LogP: 5.06490
• XLogP3: 5.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 2
• Exact Mass: 408.02081105
• Heavy Atom Count: 27
• Complexity: 452

Purity/Quality:

97% ^*data from raw suppliers

2,2-Bis(3,5-difluoro-4-hydroxyphenyl)hexafluoropropane ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1F)O)F)C(C2=CC(=C(C(=C2)F)O)F)(C(F)(F)F)C(F)(F)F
• Uses: 2,2-Bis(3,5-difluoro-4-hydroxyphenyl)hexafluoropropane was studied for its possible inhibitory activity against sarco/endoplasmic reticulum calcium ATPase.