Product Name

  • Name

    1-ETH-1-YNYL-4-HEXYLBENZENE

  • EINECS
  • CAS No. 79887-11-9
  • Article Data7
  • CAS DataBase
  • Density 0.9 g/cm3
  • Solubility
  • Melting Point
  • Formula C14H18
  • Boiling Point 263.5 °C at 760 mmHg
  • Molecular Weight 186.297
  • Flash Point 105.6 °C
  • Transport Information
  • Appearance yellow liquid
  • Safety 26-36/37/39
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 79887-11-9 (1-ETH-1-YNYL-4-HEXYLBENZENE)
  • Hazard Symbols IrritantXi
  • Synonyms 1-Ethynyl-4-hexylbenzene;4-Hexylphenylacetylene;
  • PSA 0.00000
  • LogP 3.79070

4-Hexylphenylacetylene Specification

The 4-Hexylphenylacetylene ,its cas register number is 79887-11-9.It also can be called as 1-Ethynyl-4-hexylbenzene and the Systematic name about this chemicals is 1-Ethynyl-4-hexylbenzene .It belongs to the following product categories, such as Categories: Acetylenes, Acetylenic Hydrocarbons having Benzene Ring, Building Blocks for Liquid Crystals, Chalcones, etc. (Building Blocks for Liquid Crystals) and Functional Materials .

Following are the chemical properties about 4-Hexylphenylacetylene :(1)#H bond acceptors: 0 ; (2)#H bond donors: 0 ; (3)#Freely Rotating Bonds: 5 ; (4)Polar Surface Area: 0 Å 2; (5)Index of Refraction: 1.509 ; (6)Molar Refractivity: 61.59 cm3 ; (7)Molar Volume: 205.9 cm3 ; (8)Surface Tension: 35.2 dyne/cm ; (9) Enthalpy of Vaporization: 48.11 kJ/mol ; (10)Vapour Pressure: 0.0168 mmHg at 25°C .

This chemicals is dangerous, because it irritating to eyes, respiratory system and skin. So in the using process, you need to wear suitable protective clothing, gloves and eye/face protection and in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

This chemicals can be described computed from structure:
(1)SMILES: C#Cc1ccc(cc1)CCCCCC
(2)InChI: InChI=1/C14H18/c1-3-5-6-7-8-14-11-9-13(4-2)10-12-14/h2,9-12H,3,5-8H2,1H3
(3)InChIKey: NFPDFDTYANKKIU-UHFFFAOYAP

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