Chemical Properties of 7-Butylbenz[a]anthracene (CAS 18868-65-0)

7-Butylbenz[a]anthracene

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InChI
InChI=1S/C22H20/c1-2-3-10-20-19-12-7-5-9-17(19)15-22-18-11-6-4-8-16(18)13-14-21(20)22/h4-9,11-15H,2-3,10H2,1H3
InChI Key
BIOVWIBRVOHDTA-UHFFFAOYSA-N
Formula
C22H20
SMILES
CCCCc1c2ccccc2cc2c3ccccc3ccc21
Molecular Weight1
284.39
CAS
18868-65-0
Sources

Physical Properties

Property Value Unit Source
Δf 537.83 kJ/mol Joback Calculated Property
Δfgas 277.92 kJ/mol Joback Calculated Property
Δfus 36.67 kJ/mol Joback Calculated Property
Δvap 73.75 kJ/mol Joback Calculated Property
logPoct/wat 6.49 Crippen Calculated Property
Pc 1875.65 kPa Joback Calculated Property
Tboil 801.32 K Joback Calculated Property
Tc 1043.67 K Joback Calculated Property
Tfus 499.78 K Joback Calculated Property
Vc 0.93 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 681.57 J/mol×K 801.32 Joback Calculated Property
η 0.00 Pa×s 801.32 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 7
-CH2- 3
-CH3 1
=CH- (ring) 11

Similar Compounds

1-n-butylpyrene. 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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