Chemical Properties of 1,3-Dimethyl-5-(adamantyl-1)benzene (CAS 73861-71-9)

1,3-Dimethyl-5-(adamantyl-1)benzene

InChI
InChI=1S/C18H24/c1-12-3-13(2)5-17(4-12)18-9-14-6-15(10-18)8-16(7-14)11-18/h3-5,14-16H,6-11H2,1-2H3
InChI Key
QVROSZXSMHWOAF-UHFFFAOYSA-N
Formula
C18H24
SMILES
Cc1cc(C)cc(C23CC4CC(CC(C4)C2)C3)c1
Molecular Weight1
240.38
CAS
73861-71-9
Other Names
  • 1-(3,5-Dimethylphenyl)adamantane
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Physical Properties

Property Value Unit Source
ω 0.4730 Relay (1.0) Calculated Property
ΔfG° 350.78 kJ/mol Joback Calculated Property
ΔfH°gas -96.96 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 22.72 kJ/mol Joback Calculated Property
ΔvapH° 78.98 kJ/mol Relay (1.0) Calculated Property
IE 8.21 eV Relay (1.0) Calculated Property
log10WS -6.61 Relay (1.0) Calculated Property
logPoct/wat 4.771 Crippen Calculated Property
McVol 208.140 ml/mol McGowan Calculated Property
Pc 2032.72 kPa Joback Calculated Property
Inp 1934.00 NIST
Tboil 613.67 K Relay (1.0) Calculated Property
Tc 861.32 K Relay (1.0) Calculated Property
Tfus 443.51 K Relay (1.0) Calculated Property
Vc 0.783 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [613.36; 735.15] J/mol×K [667.94; 908.75] Show Hide
Cp,gas 613.36 J/mol×K 667.94 Joback Calculated Property
Cp,gas 636.13 J/mol×K 708.07 Joback Calculated Property
Cp,gas 657.54 J/mol×K 748.21 Joback Calculated Property
Cp,gas 677.87 J/mol×K 788.34 Joback Calculated Property
Cp,gas 697.40 J/mol×K 828.48 Joback Calculated Property
Cp,gas 716.40 J/mol×K 868.61 Joback Calculated Property
Cp,gas 735.15 J/mol×K 908.75 Joback Calculated Property

Similar Compounds

1-(3-methylphenyl)-adamantane. 1,2-Dimethyl-4-(adamantyl-1)benzene. p-(Adamantyl-1)toluene. Tricyclo[3.3.1.1(3,7)]decane, 1-phenyl-. 6-Methyl-6-(3-methylphenyl)-2-heptanone. Herbertene. 2-(3,5-Dimethylphenyl)adamantane. 2-(3-methylphenyl)-adamantane. Benzene, 1-cyclohexyl-3-methyl-. Propane, 2-cyclohexyl-2-phenyl-. Phenol, 4-(1,1,3-trimethylhexyl). 2,2'-methylenebis[6-(1-methylcyclohexyl)-p-cresol]. Phenol, 4-(1-ethyl-1,3-dimethylpentyl), diastereomer # 2. Phenol, 4-(1-ethyl-1,3-dimethylpentyl), diastereomer # 1. Phenol, 4-(1-ethyl-1,3-dimethylpentyl).

Find more compounds similar to 1,3-Dimethyl-5-(adamantyl-1)benzene.

Sources

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