Chemical Properties of Hexanal, 3-methyl- (CAS 19269-28-4)

Hexanal, 3-methyl-

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InChI
InChI=1S/C7H14O/c1-3-4-7(2)5-6-8/h6-7H,3-5H2,1-2H3
InChI Key
ZSJUABCTGCNBPF-UHFFFAOYSA-N
Formula
C7H14O
SMILES
CCCC(C)CC=O
Molecular Weight1
114.19
CAS
19269-28-4
Other Names
  • 3-Methylhexanal
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Physical Properties

Property Value Unit Source
Δf -93.90 kJ/mol Joback Calculated Property
Δfgas -278.67 kJ/mol Joback Calculated Property
Δfus 12.65 kJ/mol Joback Calculated Property
Δvap 37.51 kJ/mol Joback Calculated Property
log10WS -1.79 Crippen Calculated Property
logPoct/wat 2.012 Crippen Calculated Property
McVol 111.060 ml/mol McGowan Calculated Property
Pc 3059.17 kPa Joback Calculated Property
I 1116.00 NIST
Tboil 407.78 K Joback Calculated Property
Tc 583.42 K Joback Calculated Property
Tfus 195.65 K Joback Calculated Property
Vc 0.439 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [216.97; 278.60] J/mol×K [407.78; 583.42] Show Hide
Cp,gas 216.97 J/mol×K 407.78 Joback Calculated Property
Cp,gas 228.33 J/mol×K 437.05 Joback Calculated Property
Cp,gas 239.24 J/mol×K 466.33 Joback Calculated Property
Cp,gas 249.71 J/mol×K 495.60 Joback Calculated Property
Cp,gas 259.76 J/mol×K 524.87 Joback Calculated Property
Cp,gas 269.38 J/mol×K 554.14 Joback Calculated Property
Cp,gas 278.60 J/mol×K 583.42 Joback Calculated Property
Cp,liquid 245.94 J/mol×K 323.15 NIST
η [0.0003089; 0.0075086] Pa×s [195.65; 407.78] Show Hide
η 0.0075086 Pa×s 195.65 Joback Calculated Property
η 0.0029368 Pa×s 231.00 Joback Calculated Property
η 0.0014738 Pa×s 266.36 Joback Calculated Property
η 0.0008693 Pa×s 301.72 Joback Calculated Property
η 0.0005728 Pa×s 337.07 Joback Calculated Property
η 0.0004085 Pa×s 372.42 Joback Calculated Property
η 0.0003089 Pa×s 407.78 Joback Calculated Property
ΔvapH 42.80 kJ/mol 365.50 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.68] kPa [313.98; 441.51] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.54613e+01
Coefficient B-3.90935e+03
Coefficient C-5.63390e+01
Temperature range, min.313.98
Temperature range, max.441.51
Pvap 1.33 kPa 313.98 Calculated Property
Pvap 2.94 kPa 328.15 Calculated Property
Pvap 6.00 kPa 342.32 Calculated Property
Pvap 11.43 kPa 356.49 Calculated Property
Pvap 20.57 kPa 370.66 Calculated Property
Pvap 35.17 kPa 384.83 Calculated Property
Pvap 57.54 kPa 399.00 Calculated Property
Pvap 90.51 kPa 413.17 Calculated Property
Pvap 137.55 kPa 427.34 Calculated Property
Pvap 202.68 kPa 441.51 Calculated Property

Similar Compounds

Farnasal. Octanal, 3,7-dimethyl-. Pentanal, 3-methyl-. Hexanal, 4-methyl-. Hexanal, 3,5,5-trimethyl-. Dotriacontanal, 12-methyl. 9-methyldecanal. Triacontanal, 12-methyl. 6-Methyloctanal. 7-Methylnonanal. 8-Methyldecanal. 4-Methyl-nonanal. 3,4-dimethylvaleraldehyde. Hexanal, 5-methyl-. 3,3-dimethylcyclohexaneacetaldehyde.

Find more compounds similar to Hexanal, 3-methyl-.

Sources

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