chloro[4-(chlorodimethylsilyl)phenyl]dimethylsilane

• ChemBase ID: 151655
• Molecular Formular: C10H16Cl2Si2
• Molecular Mass: 263.31104
• Monoisotopic Mass: 262.01675894
• SMILES: C[Si](C)(c1ccc(cc1)[Si](C)(C)Cl)Cl
• Canonical SMILES: C[Si](c1ccc(cc1)[Si](Cl)(C)C)(Cl)C
• InChI: InChI=1S/C10H16Cl2Si2/c1-13(2,11)9-5-7-10(8-6-9)14(3,4)12/h5-8H,1-4H3
• InChIKey: COFLYCFUVHLITN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: chloro[4-(chlorodimethylsilyl)phenyl]dimethylsilane
• IUPAC Traditional name: chloro[4-(chlorodimethylsilyl)phenyl]dimethylsilane
• Synonyms: 1,4-Bis(chlorodimethylsilyl)benzene; 1,4-Phenylenebis(chlorodimethylsilane); 1,4-双(氯二甲基硅基)苯; 1,4-亚苯基双(氯二甲基硅烷)

Database IDs

• CAS Number: 1078-97-3
• EC Number: 214-086-4
• MDL Number: MFCD00039299
• PubChem SID: 162245805; 24874689
• PubChem CID: 70650

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.6212
• LogD (pH = 7.4): 2.6212
• Log P: 2.6212
• Molar Refractivity: 60.2836 cm^3
• Polarizability: 27.183949 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 130-133 °C(lit.)
• Boiling Point: 109-110 °C/1 mmHg(lit.)

Safety Information

• European Hazard Symbols: Corrosive (C)
• UN Number: 3261
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 34
• Safety Statements: 26-36/37/39-45
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 3261 8/PG 2

Product Information

• Purity: 95%
• Linear Formula: C6H4[ClSi(CH3)2]2

DETAILS

Sigma Aldrich - 549445

Packaging
5 g in glass bottle