bicyclo[2.2.1]hept-5-en-2-yltrichlorosilane

• ChemBase ID: 108323
• Molecular Formular: C7H9Cl3Si
• Molecular Mass: 227.59086
• Monoisotopic Mass: 225.95390986
• SMILES: Cl[Si](Cl)(Cl)C1CC2CC1C=C2
• Canonical SMILES: Cl[Si](C1CC2CC1C=C2)(Cl)Cl
• InChI: InChI=1S/C7H9Cl3Si/c8-11(9,10)7-4-5-1-2-6(7)3-5/h1-2,5-7H,3-4H2
• InChIKey: RDAOXVBXDCANBV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: bicyclo[2.2.1]hept-5-en-2-yltrichlorosilane
• IUPAC Traditional name: bicyclo[2.2.1]hept-5-en-2-yltrichlorosilane
• Synonyms: BICYCLOHEPTENYL-2-TRICHLOROSILANE

Database IDs

• CAS Number: 14319-64-3
• PubChem SID: 162095499
• PubChem CID: 548689

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.0573
• LogD (pH = 7.4): 3.0573
• Log P: 3.0573
• Molar Refractivity: 48.7296 cm^3
• Polarizability: 20.44496 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05206921

MP Biomedicals Rare Chemical collection