methoxydimethyl(3,3,3-trifluoropropyl)silane

• ChemBase ID: 302498
• Molecular Formular: C6H13F3OSi
• Molecular Mass: 186.2475296
• Monoisotopic Mass: 186.06877623
• SMILES: CO[Si](C)(C)CCC(F)(F)F
• Canonical SMILES: CO[Si](CCC(F)(F)F)(C)C
• InChI: InChI=1S/C6H13F3OSi/c1-10-11(2,3)5-4-6(7,8)9/h4-5H2,1-3H3
• InChIKey: QRLCLBZGWYJTHP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methoxydimethyl(3,3,3-trifluoropropyl)silane
• IUPAC Traditional name: methoxydimethyl(3,3,3-trifluoropropyl)silane
• Synonyms: (3,3,3-Trifluoropropyl)dimethylmethoxysilane; Dimethylmethoxy(3,3,3-trifluoropropyl)silane; 二甲基甲氧基(3,3,3-氟丙基)硅烷

Database IDs

• CAS Number: 4852-13-5
• EC Number: 000-000-0
• MDL Number: MFCD00236726

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 2.7519
• LogD (pH = 7.4): 2.7519
• Log P: 2.7519
• Molar Refractivity: 34.2613 cm^3
• Polarizability: 14.87505 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Refractive Index: 1.3590

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Irritant (Xi)
• UN Number: UN1993
• Hazard Class: 3
• Packing Group: III
• Risk Statements: 10-36/37/38
• Safety Statements: 26-37
• TSCA Listed: 否
• GHS Pictograms: GHS02; GHS07
• GHS Hazard statements: H226-H315-H319-H335
• GHS Precautionary statements: P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A

Product Information

• Purity: 98%