(2-{bicyclo[2.2.1]hept-5-en-2-yl}ethyl)({4-[(2-{bicyclo[2.2.1]hept-5-en-2-yl}ethyl)dimethylsilyl]phenyl})dimethylsilane

• ChemBase ID: 150148
• Molecular Formular: C28H42Si2
• Molecular Mass: 434.80408
• Monoisotopic Mass: 434.28250441
• SMILES: C[Si](C)(CCC1CC2CC1C=C2)c1ccc(cc1)[Si](C)(C)CCC1CC2CC1C=C2
• Canonical SMILES: C[Si](c1ccc(cc1)[Si](CCC1CC2CC1C=C2)(C)C)(CCC1CC2CC1C=C2)C
• InChI: InChI=1S/C28H42Si2/c1-29(2,15-13-25-19-21-5-7-23(25)17-21)27-9-11-28(12-10-27)30(3,4)16-14-26-20-22-6-8-24(26)18-22/h5-12,21-26H,13-20H2,1-4H3
• InChIKey: QALLAEJZRWYAHS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-{bicyclo[2.2.1]hept-5-en-2-yl}ethyl)({4-[(2-{bicyclo[2.2.1]hept-5-en-2-yl}ethyl)dimethylsilyl]phenyl})dimethylsilane
• IUPAC Traditional name: (2-{bicyclo[2.2.1]hept-5-en-2-yl}ethyl)({4-[(2-{bicyclo[2.2.1]hept-5-en-2-yl}ethyl)dimethylsilyl]phenyl})dimethylsilane
• Synonyms: 1,4-Bis[dimethyl[2-(5-norbornen-2-yl)ethyl]silyl]benzene; 1,4-二[二甲基[2-(5-降冰片烯]硅基]苯

Database IDs

• CAS Number: 307496-40-8
• MDL Number: MFCD02093770
• PubChem SID: 24874349; 162244309
• PubChem CID: 5107725

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 8.4474
• LogD (pH = 7.4): 8.4474
• Log P: 8.4474
• Molar Refractivity: 126.7508 cm^3
• Polarizability: 53.398083 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Boiling Point: 314 °C(lit.)
• Flash Point: >110 °C; >230 °F
• Density: 1.06 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.5340(lit.)

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves

Product Information

• Empirical Formula (Hill Notation): C28H42Si2

DETAILS

Sigma Aldrich - 523607

Packaging
5 mL in glass bottle