Chemical Properties of 3-Pentanol, 3-(1,1-dimethylethyl)-2,2,4,4-tetramethyl- (CAS 41902-42-5)

3-Pentanol, 3-(1,1-dimethylethyl)-2,2,4,4-tetramethyl-

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InChI
InChI=1S/C13H28O/c1-10(2,3)13(14,11(4,5)6)12(7,8)9/h14H,1-9H3
InChI Key
LIUBOLYWYDGCSJ-UHFFFAOYSA-N
Formula
C13H28O
SMILES
CC(C)(C)C(O)(C(C)(C)C)C(C)(C)C
Molecular Weight1
200.36
CAS
41902-42-5
Sources

Physical Properties

Property Value Unit Source
Δcsolid -8643.90 ± 3.80 kJ/mol NIST
Δf -66.88 kJ/mol Joback Calculated Property
Δfgas -410.10 ± 4.00 kJ/mol NIST
Δfsolid -473.30 ± 3.80 kJ/mol NIST
Δfus 3.86 kJ/mol Joback Calculated Property
Δsub 63.20 ± 1.20 kJ/mol NIST
Δsub 63.20 kJ/mol NIST
Δvap 56.03 kJ/mol Joback Calculated Property
logPoct/wat 3.856 Crippen Calculated Property
Pc 1893.65 kPa Joback Calculated Property
Tboil 576.10 K Joback Calculated Property
Tc 766.16 K Joback Calculated Property
Tfus 390.15 ± 0.02 K NIST
Tfus 368.00 ± 2.00 K NIST
Vc 0.739 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 541.05 J/mol×K 576.1 Joback Calculated Property
Cp,solid 350.60 J/mol×K 298.15 NIST
η 0.0000510 Pa×s 576.1 Joback Calculated Property
ΔfusH 3.43 kJ/mol 390.0 NIST
ΔfusH 3.43 kJ/mol 390.15 NIST
ΔfusS 8.80 J/mol×K 390.15 NIST

Molecular Descriptors

Joback and Reid Groups
-OH (alcohol) 1
-CH3 9
>C< 4

Similar Compounds

3,4,4-Trimethyl-3-pentanol. 3-Pentanol, 2,3,4-trimethyl-. 3-Pentanol, 3-ethyl-2-methyl-. 3-Pentanol, 2,2,4,4-tetramethyl-. 2,2,4-Trimethyl-3-pentanol. 3-Pentanol, 2,3-dimethyl-. 2,3,3-Trimethyl-2-pentanol. 3-Pentanol, 2,2-dimethyl-. Ethanol, pentamethyl-. 3-Hexanol, 3,4-diethyl-. 1-Methyl-3-tert-butyl-3-cyclohexanol. 3,4-Dimethyl-3-hexanol. 4a(2H)-Naphthalenol, octahydro-4,8a-dimethyl-,(4«alpha»,4a«alpha»,8a«beta»)-. 2,3,4-Trimethyl-2-pentanol. 2-Pentanol, 3-ethyl-2-methyl-.

Find more compounds similar to 3-Pentanol, 3-(1,1-dimethylethyl)-2,2,4,4-tetramethyl-.

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