chloro(methyl)phenylsilane

• ChemBase ID: 152811
• Molecular Formular: C7H9ClSi
• Molecular Mass: 156.68486
• Monoisotopic Mass: 156.0162045
• SMILES: C[SiH](c1ccccc1)Cl
• Canonical SMILES: C[SiH](c1ccccc1)Cl
• InChI: InChI=1S/C7H9ClSi/c1-9(8)7-5-3-2-4-6-7/h2-6,9H,1H3
• InChIKey: GVPNBWPLCHOFMX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: chloro(methyl)phenylsilane
• IUPAC Traditional name: chloro(methyl)phenylsilane
• Synonyms: Methyl-phenyl-chlorosilane; Chloro(methyl)phenylsilane; 甲基苯基氯硅烷; 氯甲基苯基硅烷

Database IDs

• CAS Number: 1631-82-9
• EC Number: 216-633-2
• MDL Number: MFCD00045146
• Beilstein Number: 2935477
• PubChem SID: 162246954; 24885698
• PubChem CID: 6327322

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.9818
• LogD (pH = 7.4): 1.9818
• Log P: 1.9818
• Molar Refractivity: 38.1907 cm^3
• Polarizability: 16.90471 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 113 °C(lit.)
• Flash Point: 143.6 °F; 62 °C
• Density: 1.043 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.515(lit.)

Safety Information

• European Hazard Symbols: Corrosive (C)
• UN Number: 2987
• German water hazard class: 1
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 14-34
• Safety Statements: 26-36/37/39-43-45
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 2987 8/PG 2
• Supplemental Hazard Statements: Reacts violently with water.

Product Information

• Purity: ≥93.0% (GC)
• Grade: technical
• Linear Formula: C6H5SiH(CH3)Cl

DETAILS

Sigma Aldrich - 68645

Packaging
5 mL in glass bottle