(4-methoxyphenyl)(prop-2-en-1-yl)bis(propan-2-yl)silane

• ChemBase ID: 101740
• Molecular Formular: C16H26OSi
• Molecular Mass: 262.46254
• Monoisotopic Mass: 262.17529198
• SMILES: [Si](c1ccc(cc1)OC)(C(C)C)(C(C)C)CC=C
• Canonical SMILES: COc1ccc(cc1)[Si](C(C)C)(C(C)C)CC=C
• InChI: InChI=1S/C16H26OSi/c1-7-12-18(13(2)3,14(4)5)16-10-8-15(17-6)9-11-16/h7-11,13-14H,1,12H2,2-6H3
• InChIKey: SARWQYGUFKUGTK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (4-methoxyphenyl)(prop-2-en-1-yl)bis(propan-2-yl)silane
• IUPAC Traditional name: diisopropyl(4-methoxyphenyl)prop-2-en-1-ylsilane
• Synonyms: allyl(diisopropyl)(4-methoxyphenyl)silane

Database IDs

• CAS Number: 216107-40-3
• MDL Number: MFCD08060544
• PubChem SID: 162087143
• PubChem CID: 22666856

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 5.0928
• LogD (pH = 7.4): 5.0928
• Log P: 5.0928
• Molar Refractivity: 76.3283 cm^3
• Polarizability: 32.156075 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Purity: 95%