(3-bromoadamantan-1-yl)trimethylsilane

• ChemBase ID: 83526
• Molecular Formular: C13H23BrSi
• Molecular Mass: 287.31122
• Monoisotopic Mass: 286.07523927
• SMILES: [Si](C12CC3(Br)CC(C1)CC(C2)C3)(C)(C)C
• Canonical SMILES: BrC12CC3CC(C1)CC(C2)(C3)[Si](C)(C)C
• InChI: InChI=1S/C13H23BrSi/c1-15(2,3)13-7-10-4-11(8-13)6-12(14,5-10)9-13/h10-11H,4-9H2,1-3H3
• InChIKey: HVYYOYCLSZUXOR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3-bromoadamantan-1-yl)trimethylsilane
• IUPAC Traditional name: (3-bromoadamantan-1-yl)trimethylsilane
• Synonyms: (3-bromo-1-adamantyl)(trimethyl)silane

Database IDs

• MDL Number: MFCD00167838
• PubChem SID: 162070643
• PubChem CID: 2780454

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.5856
• LogD (pH = 7.4): 3.5856
• Log P: 3.5856
• Molar Refractivity: 65.6338 cm^3
• Polarizability: 28.040833 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true