Chemical Properties of 3,3-Dimethylbutanal (CAS 2987-16-8)

3,3-Dimethylbutanal

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InChI
InChI=1S/C6H12O/c1-6(2,3)4-5-7/h5H,4H2,1-3H3
InChI Key
LTNUSYNQZJZUSY-UHFFFAOYSA-N
Formula
C6H12O
SMILES
CC(C)(C)CC=O
Molecular Weight1
100.16
CAS
2987-16-8
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Physical Properties

Property Value Unit Source
Δf -97.04 kJ/mol Joback Calculated Property
Δfgas -261.50 kJ/mol Joback Calculated Property
Δfus 6.17 kJ/mol Joback Calculated Property
Δvap 34.37 kJ/mol Joback Calculated Property
log10WS -1.37 Crippen Calculated Property
logPoct/wat 1.621 Crippen Calculated Property
McVol 96.970 ml/mol McGowan Calculated Property
Pc 3456.14 kPa Joback Calculated Property
Inp 689.00 NIST
Tboil 382.11 K Joback Calculated Property
Tc 566.17 K Joback Calculated Property
Tfus 201.80 K Joback Calculated Property
Vc 0.378 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [180.97; 239.82] J/mol×K [382.11; 566.17] Show Hide
Cp,gas 180.97 J/mol×K 382.11 Joback Calculated Property
Cp,gas 192.15 J/mol×K 412.79 Joback Calculated Property
Cp,gas 202.74 J/mol×K 443.46 Joback Calculated Property
Cp,gas 212.79 J/mol×K 474.14 Joback Calculated Property
Cp,gas 222.30 J/mol×K 504.82 Joback Calculated Property
Cp,gas 231.30 J/mol×K 535.49 Joback Calculated Property
Cp,gas 239.82 J/mol×K 566.17 Joback Calculated Property
η [0.0003588; 0.0076524] Pa×s [201.80; 382.11] Show Hide
η 0.0076524 Pa×s 201.80 Joback Calculated Property
η 0.0033020 Pa×s 231.85 Joback Calculated Property
η 0.0017279 Pa×s 261.90 Joback Calculated Property
η 0.0010332 Pa×s 291.96 Joback Calculated Property
η 0.0006800 Pa×s 322.01 Joback Calculated Property
η 0.0004807 Pa×s 352.06 Joback Calculated Property
η 0.0003588 Pa×s 382.11 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.67] kPa [289.66; 415.39] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.49724e+01
Coefficient B-3.55037e+03
Coefficient C-4.78880e+01
Temperature range, min.289.66
Temperature range, max.415.39
Pvap 1.33 kPa 289.66 Calculated Property
Pvap 2.97 kPa 303.63 Calculated Property
Pvap 6.10 kPa 317.60 Calculated Property
Pvap 11.67 kPa 331.57 Calculated Property
Pvap 21.00 kPa 345.54 Calculated Property
Pvap 35.84 kPa 359.51 Calculated Property
Pvap 58.44 kPa 373.48 Calculated Property
Pvap 91.53 kPa 387.45 Calculated Property
Pvap 138.35 kPa 401.42 Calculated Property
Pvap 202.67 kPa 415.39 Calculated Property

Similar Compounds

Butanal, 3,3-dimethyl-. Butanal, 3-methyl-. Butane, 2,2-dimethyl-. Butanal, 2,2-dimethyl-. 3,3-dimethylbutyryl chloride. 2-Pentanone, 4,4-dimethyl-. Hexanal, 3,3-dimethyl-. Cyclopropane, 1,1-dimethyl-. Pentane, 3,3-dimethyl-. C2H5C(CH3)2COCH3. 2,2,5,5-Tetramethyl-3-hexanone. Pentane, 3-ethyl-3-methyl-. Butanoic acid, 3,3-dimethyl-. Hexane, 2,2,5,5-tetramethyl-. Neopentyl ethyl ketone.

Find more compounds similar to 3,3-Dimethylbutanal.

Sources

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