Chemical Properties of Hexanal, 3,5,5-trimethyl- (CAS 5435-64-3)

Hexanal, 3,5,5-trimethyl-

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InChI
InChI=1S/C9H18O/c1-8(5-6-10)7-9(2,3)4/h6,8H,5,7H2,1-4H3
InChI Key
WTPYRCJDOZVZON-UHFFFAOYSA-N
Formula
C9H18O
SMILES
CC(CC=O)CC(C)(C)C
Molecular Weight1
142.24
CAS
5435-64-3
Other Names
  • 3,5,5-Trimethyl n-hexanal
  • 3,5,5-Trimethylhexanal
  • Isonylaldehyde
  • tert-Butylisopentanal

Physical Properties

Property Value Unit Source
Δf -74.22 kJ/mol Joback Calculated Property
Δfgas -328.70 kJ/mol Joback Calculated Property
Δfus 10.42 kJ/mol Joback Calculated Property
Δvap 40.66 kJ/mol Joback Calculated Property
log10WS -2.39 Crippen Calculated Property
logPoct/wat 2.648 Crippen Calculated Property
McVol 139.240 ml/mol McGowan Calculated Property
Pc 2548.19 kPa Joback Calculated Property
Inp [963.00; 963.00]   Show Hide
Inp 963.00 NIST
Inp 963.00 NIST
I 1200.00 NIST
Tboil 450.31 K Joback Calculated Property
Tc 634.52 K Joback Calculated Property
Tfus 220.61 K Joback Calculated Property
Vc 0.539 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [301.10; 379.34] J/mol×K [450.31; 634.52] Show Hide
Cp,gas 301.10 J/mol×K 450.31 Joback Calculated Property
Cp,gas 315.91 J/mol×K 481.01 Joback Calculated Property
Cp,gas 329.97 J/mol×K 511.71 Joback Calculated Property
Cp,gas 343.32 J/mol×K 542.42 Joback Calculated Property
Cp,gas 355.98 J/mol×K 573.12 Joback Calculated Property
Cp,gas 367.97 J/mol×K 603.82 Joback Calculated Property
Cp,gas 379.34 J/mol×K 634.52 Joback Calculated Property
η [0.0002975; 0.0128554] Pa×s [220.61; 450.31] Show Hide
η 0.0128554 Pa×s 220.61 Joback Calculated Property
η 0.0043144 Pa×s 258.89 Joback Calculated Property
η 0.0019183 Pa×s 297.18 Joback Calculated Property
η 0.0010263 Pa×s 335.46 Joback Calculated Property
η 0.0006241 Pa×s 373.74 Joback Calculated Property
η 0.0004163 Pa×s 412.03 Joback Calculated Property
η 0.0002975 Pa×s 450.31 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 340.70 K 0.40 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.66] kPa [347.30; 491.05] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.50694e+01
Coefficient B-4.12718e+03
Coefficient C-6.80910e+01
Temperature range, min.347.30
Temperature range, max.491.05
Pvap 1.33 kPa 347.30 Calculated Property
Pvap 2.97 kPa 363.27 Calculated Property
Pvap 6.08 kPa 379.24 Calculated Property
Pvap 11.62 kPa 395.22 Calculated Property
Pvap 20.91 kPa 411.19 Calculated Property
Pvap 35.71 kPa 427.16 Calculated Property
Pvap 58.26 kPa 443.13 Calculated Property
Pvap 91.32 kPa 459.11 Calculated Property
Pvap 138.18 kPa 475.08 Calculated Property
Pvap 202.66 kPa 491.05 Calculated Property

Similar Compounds

3,3-dimethylcyclohexaneacetaldehyde. Hexanal, 3-methyl-. Farnasal. Octanal, 3,7-dimethyl-. Cyclohexanone, 3,3,5-trimethyl-. Triacontanal, 12-methyl. 9-methyldecanal. Dotriacontanal, 12-methyl. 6-Methyloctanal. 8-Methyldecanal. 7-Methylnonanal. 3,3-dimethylcyclohexanecarboxaldehyde. 3,4-dimethylvaleraldehyde. Cyclohexene-1-acetaldehyde, 2,6,6-trimethyl. Hexanal, 5-methyl-.

Find more compounds similar to Hexanal, 3,5,5-trimethyl-.

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