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Ethanone, 1-(4-hydroxybenzo[b]thien-5-yl)-

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  • Name Ethanone, 1-(4-hydroxybenzo[b]thien-5-yl)-
  • EINECSN/A
  • CAS No. 82194-64-7
  • Density1.344 g/cm3
  • PSAN/A
  • LogPN/A
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC10H8O2S
  • Boiling Point337.8 °C at 760 mmHg
  • Molecular Weight192.2343
  • Flash Point158.1 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 82194-64-7 (Ethanone, 1-(4-hydroxybenzo[b]thien-5-yl)-)
  • Hazard SymbolsN/A
  • SynonymsN/A

Ethanone, 1-(4-hydroxybenzo[b]thien-5-yl)- Specification

The CAS registry number of Ethanone, 1-(4-hydroxybenzo[b]thien-5-yl)- is 82194-64-7. This chemical's molecular formula is C10H8O2S and molecular weight is 192.2343. What's more, its systematic name is called 1-(4-Hydroxy-1-benzothiophen-5-yl)ethanone.

Physical properties about Ethanone, 1-(4-hydroxybenzo[b]thien-5-yl)- are: (1)ACD/LogP: 4.13; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 54.54 Å2; (7)Index of Refraction: 1.685; (8)Molar Refractivity: 54.38 cm3; (9)Molar Volume: 142.9 cm3; (10)Surface Tension: 57.9 dyne/cm; (11)Density: 1.344 g/cm3; (12)Flash Point: 158.1 °C; (13)Enthalpy of Vaporization: 60.41 kJ/mol; (14)Boiling Point: 337.8 °C at 760 mmHg; (15)Vapour Pressure: 5.25E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c2c(O)c1c(scc1)cc2)C
(2) InChI: InChI=1/C10H8O2S/c1-6(11)7-2-3-9-8(10(7)12)4-5-13-9/h2-5,12H,1H3
(3) InChIKey: YUOYLURWXNTBHJ-UHFFFAOYAV

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