3-bromophenoxytris(propan-2-yl)silane

• ChemBase ID: 92175
• Molecular Formular: C15H25BrOSi
• Molecular Mass: 329.3479
• Monoisotopic Mass: 328.08580395
• SMILES: [Si](C(C)C)(Oc1cccc(c1)Br)(C(C)C)C(C)C
• Canonical SMILES: Brc1cccc(c1)O[Si](C(C)C)(C(C)C)C(C)C
• InChI: InChI=1S/C15H25BrOSi/c1-11(2)18(12(3)4,13(5)6)17-15-9-7-8-14(16)10-15/h7-13H,1-6H3
• InChIKey: YOSBXSDNMZXREZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-bromophenoxytris(propan-2-yl)silane
• IUPAC Traditional name: 3-bromophenoxytriisopropylsilane
• Synonyms: (3-Bromophenoxy)triisopropylsilane 97%; (3-bromophenoxy)triisopropylsilane

Database IDs

• CAS Number: 571202-87-4
• MDL Number: MFCD08690328
• PubChem SID: 162078873
• PubChem CID: 22605976

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 6.0991
• LogD (pH = 7.4): 6.0991
• Log P: 6.0991
• Molar Refractivity: 79.123 cm^3
• Polarizability: 33.197094 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Warning: Harmful

Product Information

• Purity: 97%