Chemical Properties of Naphthalene, 2-(1,1-dimethylethyl)-1,2,3,4-tetrahydro- (CAS 42044-22-4)

Naphthalene, 2-(1,1-dimethylethyl)-1,2,3,4-tetrahydro-

InChI
InChI=1S/C14H20/c1-14(2,3)13-9-8-11-6-4-5-7-12(11)10-13/h4-7,13H,8-10H2,1-3H3
InChI Key
FCXYHCYNCWKCOS-UHFFFAOYSA-N
Formula
C14H20
SMILES
CC(C)(C)C1CCc2ccccc2C1
Molecular Weight1
188.31
CAS
42044-22-4
Other Names
  • 2-tert-Butyl-1,2,3,4-Tetrahydronaphthalene
  • 2-tert-Butyltetralin
  • Naphthalene, 1,2,3,4-tetrahydro-2-(1,1-dimethylethyl)
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Physical Properties

Property Value Unit Source
ΔfH°gas -20.49 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 14.29 kJ/mol Joback Calculated Property
ΔvapH° 65.94 kJ/mol Relay (1.0) Calculated Property
IE 8.48 eV Relay (1.0) Calculated Property
logPoct/wat 3.838 Crippen Calculated Property
McVol 173.500 ml/mol McGowan Calculated Property
Pc 2329.27 kPa Joback Calculated Property
Inp [1475.00; 1475.00]   Show Hide
Inp 1475.00 NIST
Inp 1475.00 NIST
Tboil 543.65 K Relay (1.0) Calculated Property
Tc 761.70 K Relay (1.0) Calculated Property
Tfus 294.64 K Relay (1.0) Calculated Property
Vc 0.613 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [217.97; 603.02] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.09280e+02
Coefficient B1.46256e+00
Coefficient C-1.04756e-03
Coefficient D2.97300e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 217.97 J/mol×K 273.00 Calculated Property
Cp,gas 290.19 J/mol×K 353.78 Calculated Property
Cp,gas 352.86 J/mol×K 434.56 Calculated Property
Cp,gas 406.91 J/mol×K 515.33 Calculated Property
Cp,gas 453.30 J/mol×K 596.11 Calculated Property
Cp,gas 492.94 J/mol×K 676.89 Calculated Property
Cp,gas 526.80 J/mol×K 757.67 Calculated Property
Cp,gas 555.81 J/mol×K 838.44 Calculated Property
Cp,gas 580.90 J/mol×K 919.22 Calculated Property
Cp,gas 603.02 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0029253; 0.0002916] Pa×s [303.32; 553.06] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.09409e+01
Coefficient B1.54891e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.303.32
Temperature range, max.553.06
η 0.0029253 Pa×s 303.32 Calculated Property
η 0.0019067 Pa×s 331.07 Calculated Property
η 0.0013279 Pa×s 358.82 Calculated Property
η 0.0009740 Pa×s 386.57 Calculated Property
η 0.0007448 Pa×s 414.32 Calculated Property
η 0.0005890 Pa×s 442.07 Calculated Property
η 0.0004789 Pa×s 469.81 Calculated Property
η 0.0003985 Pa×s 497.56 Calculated Property
η 0.0003380 Pa×s 525.31 Calculated Property
η 0.0002916 Pa×s 553.06 Calculated Property

Similar Compounds

Naphthalene, 1,2,3,4-tetrahydro-2-(1-methylethyl). Naphthalene, 2-ethyl-1,2,3,4-tetrahydro-. 2,2'-Binaphthalene, 1,1',2,2',3,3',4,4'-octahydro-. Tetraline, 2-propyl. Tetraline, 2-butyl. Naphthalene, 1,2,3,4-tetrahydro-2-methyl-. Naphthalene, 1,2,3,4-tetrahydro-2,6-dimethyl-. Naphthalene, 1,2,3,4-tetrahydro-2,7-dimethyl-. 1,2,3,4,4a,9,10,10a-Octahydrophenanthrene (trans). 1,2,3,4,4a,9,10,10a-Octahydrophenanthrene (cis). Naphthalene, 1,2,3,4-tetrahydro-2-(phenylmethyl)-. 1,3,5(10)-Oestratriene. 1H-Cyclopropa[a]naphthalene,1a,2,3,7b-tetrahydro-. 1-t-Butyltetralin. 1H-Indene, 2-hexadecyl-2,3-dihydro-.

Find more compounds similar to Naphthalene, 2-(1,1-dimethylethyl)-1,2,3,4-tetrahydro-.

Sources

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