trichloro(cyclopentyl)silane

• ChemBase ID: 140063
• Molecular Formular: C5H9Cl3Si
• Molecular Mass: 203.56946
• Monoisotopic Mass: 201.95390986
• SMILES: C1CCC(C1)[Si](Cl)(Cl)Cl
• Canonical SMILES: Cl[Si](C1CCCC1)(Cl)Cl
• InChI: InChI=1S/C5H9Cl3Si/c6-9(7,8)5-3-1-2-4-5/h5H,1-4H2
• InChIKey: FCMZRNUHEXJWGB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: trichloro(cyclopentyl)silane
• IUPAC Traditional name: trichloro(cyclopentyl)silane
• Synonyms: Trichlorocyclopentylsilane; Trichlorocyclopentylsilane; Cyclopentyltrichlorosilane; 三氯环戊基硅烷; 环戊基三氯硅烷

Database IDs

• CAS Number: 14579-03-4
• EC Number: 238-621-6
• MDL Number: MFCD00236508
• Beilstein Number: 2935230
• PubChem SID: 162234307; 24868229
• PubChem CID: 84533

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.0882
• LogD (pH = 7.4): 3.0882
• Log P: 3.0882
• Molar Refractivity: 40.395 cm^3
• Polarizability: 17.768272 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 178-179°C; 181 °C(lit.)
• Flash Point: 154.4 °F; 68 °C; 68°C(154°F)
• Density: 1.226; 1.226 g/mL at 25 °C(lit.)
• Refractive Index: 1.4705; n20/D 1.469(lit.)

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Corrosive (C)
• UN Number: 2987; UN2987
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2; II
• Risk Statements: 14-34
• Safety Statements: 26-27-36/37/39-45; 26-36/37/39-45
• TSCA Listed: 是
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314; H314-H318-H227
• GHS Precautionary statements: P280-P303+P361+P353-P305+P351+P338-P310-P402+P404; 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: 95%; 97%
• Linear Formula: C5H9SiCl3

DETAILS

Sigma Aldrich - 446181

Packaging
25 mL in glass bottle