trichloro(5-methylcyclohex-1-en-1-yl)silane

• ChemBase ID: 108025
• Molecular Formular: C7H11Cl3Si
• Molecular Mass: 229.60674
• Monoisotopic Mass: 227.96955992
• SMILES: CC1CCC=C(C1)[Si](Cl)(Cl)Cl
• Canonical SMILES: CC1CCC=C(C1)[Si](Cl)(Cl)Cl
• InChI: InChI=1S/C7H11Cl3Si/c1-6-3-2-4-7(5-6)11(8,9)10/h4,6H,2-3,5H2,1H3
• InChIKey: OQECHPDQNWTFCF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: trichloro(5-methylcyclohex-1-en-1-yl)silane
• IUPAC Traditional name: trichloro(5-methylcyclohex-1-en-1-yl)silane
• Synonyms: β-TRICHLOROSILYL-4-ETHYL-1-CYCLOHEXENE

Database IDs

• PubChem SID: 162106168
• PubChem CID: 44135732

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.067
• LogD (pH = 7.4): 3.067
• Log P: 3.067
• Molar Refractivity: 51.1618 cm^3
• Polarizability: 21.152319 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05205791

MP Biomedicals Rare Chemical collection