Chemical Properties of Benzenamine, 2,4,6-tris(1,1-dimethylethyl)- (CAS 961-38-6)

Benzenamine, 2,4,6-tris(1,1-dimethylethyl)-

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InChI
InChI=1S/C18H31N/c1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9/h10-11H,19H2,1-9H3
InChI Key
REJGDSCBQPJPQT-UHFFFAOYSA-N
Formula
C18H31N
SMILES
CC(C)(C)c1cc(C(C)(C)C)c(N)c(C(C)(C)C)c1
Molecular Weight1
261.45
CAS
961-38-6
Other Names
  • 2,4,6-tri-t-Butylaniline
  • 2,4,6-tri-tert-Butylaniline
  • Aniline, 2,4,6-tri-tert-butyl-
  • Aniline, tri-tert-butyl-
Sources

Physical Properties

Property Value Unit Source
Δf 259.17 kJ/mol Joback Calculated Property
Δfgas -205.19 kJ/mol Joback Calculated Property
Δfus 18.21 kJ/mol Joback Calculated Property
Δsub 92.50 ± 1.10 kJ/mol NIST
Δvap 66.68 kJ/mol Joback Calculated Property
IE 6.90 eV NIST
IE 7.30 eV NIST
logPoct/wat 5.16 Crippen Calculated Property
Pc 1542.71 kPa Joback Calculated Property
Tboil 715.70 K Joback Calculated Property
Tc 941.27 K Joback Calculated Property
Tfus 447.12 K Joback Calculated Property
Vc 0.93 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 736.39 J/mol×K 715.7 Joback Calculated Property
ΔfusH 19.38 kJ/mol 426.4 NIST

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 4
-CH3 9
>C< 3
=CH- (ring) 2
-NH2 1

Similar Compounds

Aniline, 2-methyl-4,6-di-tert-butyl-. Aniline, 2,6-di-tert-butyl-4-methyl-. Aniline, 2,4-dimethyl-6-tert-butyl-. Aniline, 2,4-di-tert-butyl-. Aniline, 4-tert-butyl-2,6-diethyl-. Aniline, 2,4,6-triisopropyl-. Aniline, 2-tert-butyl-4-methyl-. 2-Methyl-6-t-butylaniline. Benzenamine, 2,6-bis(1-methylethyl)-. 1,3,5-tri(tert-butyl)-2-nitrosobenzene. Aniline, 2,4,-di-tert-butyl-n-methyl-. Aniline, 4-tert-butyl-2-methyl-. Aniline, 2,4-di-sec-butyl-. 2,6-Diethyl-p-toluidine. Bis-(4-amino-5-tert-butyl-3-methylphenyl)methane.

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