Chemical Properties of 1-Chloro-4-(1,1-dimethylethyl)benzene (CAS 3972-56-3)

1-Chloro-4-(1,1-dimethylethyl)benzene

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InChI
InChI=1S/C10H13Cl/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,1-3H3
InChI Key
XRTANKYQJQXSFP-UHFFFAOYSA-N
Formula
C10H13Cl
SMILES
CC(C)(C)c1ccc(Cl)cc1
Molecular Weight1
168.66
CAS
3972-56-3
Other Names
  • Benzene, 1-chloro-4-(1,1-dimethylethyl)-
  • Benzene, 1-tert-butyl-4-chloro-
  • p-Chloro-tert-butylbenzene
  • 1-tert-Butyl-4-chlorobenzene
  • p-tert-Butylchlorobenzene
  • 4-Chloro-tert-butylbenzene
  • 4-tert-Butyl-chlorobenzene
  • 4-tert-butyl-1-chlorobenzene
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Physical Properties

Property Value Unit Source
Δf 127.01 kJ/mol Joback Calculated Property
Δfgas -49.16 kJ/mol Joback Calculated Property
Δfliquid -108.00 ± 3.00 kJ/mol NIST
Δfus 12.09 kJ/mol Joback Calculated Property
Δvap 43.88 kJ/mol Joback Calculated Property
IE [8.48; 8.82] eV Show Hide
IE 8.56 ± 0.02 eV NIST
IE 8.48 eV NIST
IE 8.70 eV NIST
IE 8.82 eV NIST
log10WS -3.47 Crippen Calculated Property
logPoct/wat 3.637 Crippen Calculated Property
McVol 140.240 ml/mol McGowan Calculated Property
Pc 2829.33 kPa Joback Calculated Property
Tboil [484.20; 488.00] K Show Hide
Tboil 484.20 K NIST
Tboil 485.00 ± 5.00 K NIST
Tboil 488.00 ± 3.00 K NIST
Tc 720.15 K Joback Calculated Property
Tfus 273.74 K Joback Calculated Property
Vc 0.525 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [288.69; 365.18] J/mol×K [494.06; 720.15] Show Hide
Cp,gas 288.69 J/mol×K 494.06 Joback Calculated Property
Cp,gas 303.90 J/mol×K 531.74 Joback Calculated Property
Cp,gas 318.04 J/mol×K 569.42 Joback Calculated Property
Cp,gas 331.18 J/mol×K 607.10 Joback Calculated Property
Cp,gas 343.37 J/mol×K 644.79 Joback Calculated Property
Cp,gas 354.69 J/mol×K 682.47 Joback Calculated Property
Cp,gas 365.18 J/mol×K 720.15 Joback Calculated Property
η [0.0002270; 0.0033165] Pa×s [273.74; 494.06] Show Hide
η 0.0033165 Pa×s 273.74 Joback Calculated Property
η 0.0016285 Pa×s 310.46 Joback Calculated Property
η 0.0009295 Pa×s 347.18 Joback Calculated Property
η 0.0005906 Pa×s 383.90 Joback Calculated Property
η 0.0004062 Pa×s 420.62 Joback Calculated Property
η 0.0002967 Pa×s 457.34 Joback Calculated Property
η 0.0002270 Pa×s 494.06 Joback Calculated Property

Similar Compounds

m-Tert-butyl chlorobenzene. Benzene, tert-butyl-. Benzene, 1,4-bis(1,1-dimethylethyl)-. 2,4-Di-t-butyl chlorobenzene. 4-t-Butylbenzonitrile. Benzene, 1,3-bis(1,1-dimethylethyl)-. Benzene, 1-chloro-4-(1-methylethyl)-. Benzene, 1-bromo-4-(1,1-dimethylethyl)-. 4-tert-Butyltoluene. Naphthalene, 2,6-bis(1,1-dimethylethyl)-. Naphthalene, 2-(1,1-dimethylethyl)-. Anthracene, 2-(1,1-dimethylethyl)-. Ethanone, 1-[4-(1,1-dimethylethyl)phenyl]-. Benzene, 2-chloro-1-methyl-4-(1,1-dimethylethyl). 4-t-Butylphenyl isothiocyanate.

Find more compounds similar to 1-Chloro-4-(1,1-dimethylethyl)benzene.

Sources

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