Product Name

  • Name

    METHYL 3-(TRIMETHYLSILYL)-4-PENTENOATE

  • EINECS 1592732-453-0
  • CAS No. 185411-12-5
  • Density 0.879 g/cm3
  • Solubility
  • Melting Point
  • Formula C9H18O2Si
  • Boiling Point 176.7 °C at 760 mmHg
  • Molecular Weight 186.326
  • Flash Point 50.9 °C
  • Transport Information
  • Appearance COLORLESS LIQUID
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 185411-12-5 (METHYL 3-(TRIMETHYLSILYL)-4-PENTENOATE)
  • Hazard Symbols
  • Synonyms Methyl 3-(trimethylsilyl)-4-pentenoate;
  • PSA 26.30000
  • LogP 2.44390

4-Pentenoic acid,3-(trimethylsilyl)-, methyl ester Specification

The 4-Pentenoic acid,3-(trimethylsilyl)-, methyl ester, with the CAS registry number 185411-12-5, is also known as Methyl 3-(trimethylsilyl)-4-pentenoate. It belongs to the product categories of C8 to C9; Carbonyl Compounds; Esters. This chemical's molecular formula is C9H18O2Si and molecular weight is 186.3235. What's more, its systematic name is Methyl 3-(trimethylsilyl)pent-4-enoate.

Physical properties about 4-Pentenoic acid,3-(trimethylsilyl)-, methyl ester are: (1)ACD/LogP: 2.82; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.422; (8)Molar Refractivity: 53.92 cm3; (9)Molar Volume: 211.7 cm3; (10)Polarizability: 21.37×10-24 cm3; (11)Surface Tension: 22.3 dyne/cm; (12)Density: 0.879 g/cm3; (13)Flash Point: 50.9 °C; (14)Enthalpy of Vaporization: 41.3 kJ/mol; (15)Boiling Point: 176.7 °C at 760 mmHg; (16)Vapour Pressure: 1.08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OC)CC(\C=C)[Si](C)(C)C
(2) InChI: InChI=1/C9H18O2Si/c1-6-8(12(3,4)5)7-9(10)11-2/h6,8H,1,7H2,2-5H3
(3) InChIKey: DJXDHDYQDMVTPZ-UHFFFAOYAE

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