Chemical Properties of Hexane, 2,3,5-trimethyl- (CAS 1069-53-0)

Hexane, 2,3,5-trimethyl-

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C9H20/c1-7(2)6-9(5)8(3)4/h7-9H,6H2,1-5H3
InChI Key
ODGLTLJZCVNPBU-UHFFFAOYSA-N
Formula
C9H20
SMILES
CC(C)CC(C)C(C)C
Molecular Weight1
128.26
CAS
1069-53-0
Other Names
  • 2,3,5-Trimethylhexane
Sources

Physical Properties

Property Value Unit Source
Δcliquid -6115.88 ± 0.84 kJ/mol NIST
Δf 17.58 kJ/mol Joback Calculated Property
Δfgas -242.60 kJ/mol NIST
Δfliquid -284.00 ± 1.00 kJ/mol NIST
Δfus 8.50 kJ/mol Joback Calculated Property
Δvap [41.40; 41.45] kJ/mol Show Hide
Δvap 41.45 kJ/mol NIST
Δvap 41.40 kJ/mol NIST
Δvap 41.40 kJ/mol NIST
Δvap 41.42 kJ/mol NIST
logPoct/wat 3.32 Crippen Calculated Property
Pc 2361.07 kPa Joback Calculated Property
Tboil [402.00; 405.00] K Show Hide
Tboil 404.50 K NIST
Tboil 403.40 ± 0.60 K NIST
Tboil 404.52 ± 0.10 K NIST
Tboil 404.46 ± 0.25 K NIST
Tboil 404.46 ± 0.30 K NIST
Tboil Outlier 402.00 ± 2.00 K NIST
Tboil 403.45 ± 0.50 K NIST
Tboil 403.45 ± 0.50 K NIST
Tboil 405.00 ± 0.40 K NIST
Tc 578.35 K Joback Calculated Property
Tfus 145.25 ± 0.15 K NIST
Tfus 145.25 ± 0.30 K NIST
Vc 0.52 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 272.44 J/mol×K 404.0 Joback Calculated Property
η 0.00 Pa×s 404.0 Joback Calculated Property
ΔvapH 34.43 kJ/mol 404.5 NIST

Molecular Descriptors

Joback and Reid Groups
>CH- 3
-CH2- 1
-CH3 5

Similar Compounds

Hexane, 2,3,4,5-tetramethyl-. Hexane, 2,3,4,5-tetramethyl-, erythro. HEXANE, 3-ETHYL-2,5-DIMETHYL-. Heptane, 2,3,5-trimethyl-. 2,3,5-Trimethylheptane, threo. 2,3,5-Trimethylheptane, erythro. Hexane, 2,3,4-trimethyl-. Hexane, 2,3-dimethyl-. Decane, 2,3,5-trimethyl-. Heptane, 2,4,5-trimethyl-. Decane, 2,3,5,8-tetramethyl-. 2,2,4,5-Tetramethylhexane. Hexane, 2,4-dimethyl-. Heptane, 3,4,5-trimethyl-. Heptane, 3,4,5-trimethyl-, erythro.

Find more compounds similar to Hexane, 2,3,5-trimethyl-.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.