Chemical Properties of Tricyclo[3.3.1.1(3,7)]decane-1-carbonitrile (CAS 23074-42-2)

Tricyclo[3.3.1.1(3,7)]decane-1-carbonitrile

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InChI
InChI=1S/C11H15N/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-6H2
InChI Key
FQFZASRJFRAEIH-UHFFFAOYSA-N
Formula
C11H15N
SMILES
N#CC12CC3CC(CC(C3)C1)C2
Molecular Weight1
161.24
CAS
23074-42-2
Other Names
  • 1-Adamantanecarbonitrile
  • 1-Adamantane carboxylic acid nitrile
  • 1-Adamantyl cyanide
  • 1-Adamantylnitrile
  • 1-Cyanoadamantane
  • Tricyclo[3.3.1.13,7]decane-1-carbonitrile
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Physical Properties

Property Value Unit Source
PAff 834.40 kJ/mol NIST
BasG 803.80 kJ/mol NIST
Δcsolid [-6388.80; -6384.00] kJ/mol Show Hide
Δcsolid -6384.00 ± 2.10 kJ/mol NIST
Δcsolid -6388.80 ± 1.80 kJ/mol NIST
Δf 331.87 kJ/mol Joback Calculated Property
Δfgas [-21.00; -7.50] kJ/mol Show Hide
Δfgas -21.00 ± 2.60 kJ/mol NIST
Δfgas -7.50 ± 2.10 kJ/mol NIST
Δfsolid [-88.30; -83.50] kJ/mol Show Hide
Δfsolid -88.30 ± 2.50 kJ/mol NIST
Δfsolid -83.50 ± 1.80 kJ/mol NIST
Δfus 12.83 kJ/mol Joback Calculated Property
Δsub [67.20; 76.00] kJ/mol Show Hide
Δsub 67.30 ± 0.80 kJ/mol NIST
Δsub 67.30 kJ/mol NIST
Δsub 67.20 ± 0.80 kJ/mol NIST
Δsub 76.00 ± 1.10 kJ/mol NIST
Δsub 76.00 kJ/mol NIST
Δvap 49.01 kJ/mol Joback Calculated Property
log10WS -3.01 Crippen Calculated Property
logPoct/wat 2.726 Crippen Calculated Property
McVol 134.650 ml/mol McGowan Calculated Property
Pc 2853.57 kPa Joback Calculated Property
Tboil 573.22 K Joback Calculated Property
Tc 811.33 K Joback Calculated Property
Tfus 458.00 ± 1.00 K NIST
Vc 0.537 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [365.36; 454.38] J/mol×K [573.22; 811.33] Show Hide
Cp,gas 365.36 J/mol×K 573.22 Joback Calculated Property
Cp,gas 382.83 J/mol×K 612.91 Joback Calculated Property
Cp,gas 398.92 J/mol×K 652.59 Joback Calculated Property
Cp,gas 413.87 J/mol×K 692.28 Joback Calculated Property
Cp,gas 427.94 J/mol×K 731.96 Joback Calculated Property
Cp,gas 441.36 J/mol×K 771.65 Joback Calculated Property
Cp,gas 454.38 J/mol×K 811.33 Joback Calculated Property
Cp,solid 218.60 J/mol×K 298.15 NIST
ΔfusH [5.50; 15.00] kJ/mol [280.00; 458.00] Show Hide
ΔfusH 5.50 kJ/mol 280.00 NIST
ΔfusH 15.00 kJ/mol 458.00 NIST
ΔfusH 15.00 kJ/mol 458.00 NIST
ΔsubH 67.10 ± 0.80 kJ/mol 303.00 NIST
ΔfusS [19.64; 32.75] J/mol×K [280.00; 458.00] Show Hide
ΔfusS 19.64 J/mol×K 280.00 NIST
ΔfusS 32.75 J/mol×K 458.00 NIST

Similar Compounds

1-Norbornyl cyanide. Tetraisobutylsucccinonitrile. Adamantane, 1,3-dimethyl-. 1-Methyladamantane. 5-methyl-adamantane. 1,3-Diethyladamantane. 1-Ethyladamantane. 1,1'-diadamantane. 1-Methyl-3-ethyladamantane. 1,3,5-Trimethyladamantane. 1-propyladamantane. 1-n-butyladamantane. 1,2'-diadamantane. Cyclohexane, 1,1,3,5-tetramethyl-, cis-. Cyclohexane, 1,1,3,5-tetramethyl-, trans-.

Find more compounds similar to Tricyclo[3.3.1.1(3,7)]decane-1-carbonitrile.

Sources

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