Chemical Properties of 1-n-butylpyrene

1-n-butylpyrene

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InChI
InChI=1S/C20H18/c1-2-3-5-14-8-9-17-11-10-15-6-4-7-16-12-13-18(14)20(17)19(15)16/h4,6-13H,2-3,5H2,1H3
InChI Key
UFOTZLIYHMGVAV-UHFFFAOYSA-N
Formula
C20H18
SMILES
CCCCc1ccc2ccc3cccc4ccc1c2c34
Molecular Weight1
258.36
Other Names
  • Pyrene, 1-butyl
Sources

Physical Properties

Property Value Unit Source
Δf 515.23 kJ/mol Joback Calculated Property
Δfgas 273.74 kJ/mol Joback Calculated Property
Δfus 34.46 kJ/mol Joback Calculated Property
Δvap 68.66 kJ/mol Joback Calculated Property
logPoct/wat 5.93 Crippen Calculated Property
Pc 2060.49 kPa Joback Calculated Property
Tboil 747.86 K Joback Calculated Property
Tc 983.69 K Joback Calculated Property
Tfus 483.52 K Joback Calculated Property
Vc 0.84 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 591.79 J/mol×K 747.86 Joback Calculated Property
η 0.00 Pa×s 747.86 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 7
-CH2- 3
-CH3 1
=CH- (ring) 9

Similar Compounds

7-Butylbenz[a]anthracene. Phenanthrene, 9-butyl-. Anthracene, 9-butyl-. 9-n-propylphenanthrene. Benz[a]anthracene, 8-propyl-. Perylene, 3-hexyl-. Naphthalene, 1-butyl-. Phenanthrene, 9-nonyl-. Chrysene, 6-octyl-. Pyrene, 1-decyl-. 9-N-dodecyl-phenanthrene. 7-Butyl-12-methylbenz[a]anthracene. ANTHRACENE, 9-PROPYL-. 1-Pentylnaphthalene. Naphthalene, 1,1'-(1,4-butanediyl)bis-.

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