2-(5-Bromo-2-(2,2,2-trifluoroethoxy)phenyl)adamantane

Base Information

• Chemical Name: 2-(5-Bromo-2-(2,2,2-trifluoroethoxy)phenyl)adamantane
• CAS No.: 929000-50-0
• Molecular Formula: C18H20BrF3O
• Molecular Weight: 389.25
• Hs Code.: 2909309090
• DSSTox Substance ID: DTXSID70703137
• Wikidata: Q82635214
• Mol file: 929000-50-0.mol

Synonyms:929000-50-0;2-(5-Bromo-2-(2,2,2-trifluoroethoxy)phenyl)adamantane;2-[5-bromo-2-(2,2,2-trifluoroethoxy)phenyl]adamantane;2-(5-Bromo-2-(2,2,2-trifluoroethoxy)-phenyl)adamantane;DTXSID70703137;AKOS015840938;2-[5-Bromo-2-(2,2,2-trifluoroethoxy)phenyl]tricyclo[3.3.1.1~3,7~]decane

Chemical Property of 2-(5-Bromo-2-(2,2,2-trifluoroethoxy)phenyl)adamantane

Chemical Property:

• PSA: 9.23000
• LogP: 5.85800
• XLogP3: 6.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 388.06496
• Heavy Atom Count: 23
• Complexity: 411

Purity/Quality:

≥95% ^*data from raw suppliers

2-Adamantyl-4-bromo-1-(2,2,2-trifluoroethoxy)benzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2CC3CC1CC(C2)C3C4=C(C=CC(=C4)Br)OCC(F)(F)F