Chemical Properties of Pentanal, 4-methyl- (CAS 1119-16-0)

Pentanal, 4-methyl-

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InChI
InChI=1S/C6H12O/c1-6(2)4-3-5-7/h5-6H,3-4H2,1-2H3
InChI Key
JGEGJYXHCFUMJF-UHFFFAOYSA-N
Formula
C6H12O
SMILES
CC(C)CCC=O
Molecular Weight1
100.16
CAS
1119-16-0
Other Names
  • 4-methylvaleraldehyde
  • Pentanal, 4-methyl-
Sources

Physical Properties

Property Value Unit Source
Δf -102.32 kJ/mol Joback Calculated Property
Δfgas -258.03 kJ/mol Joback Calculated Property
Δfus 10.06 kJ/mol Joback Calculated Property
Δvap 35.28 kJ/mol Joback Calculated Property
IE 9.80 eV NIST
logPoct/wat 1.62 Crippen Calculated Property
Pc 3411.87 kPa Joback Calculated Property
Tboil [394.15; 397.15] K Show Hide
Tboil 394.15 ± 3.00 K NIST
Tboil Outlier 397.15 ± 3.00 K NIST
Tboil 395.15 ± 1.50 K NIST
Tboil 394.15 ± 2.00 K NIST
Tboil 394.25 ± 1.50 K NIST
Tboil 395.15 ± 2.00 K NIST
Tc 561.39 K Joback Calculated Property
Tfus 184.38 K Joback Calculated Property
Vc 0.38 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 179.50 J/mol×K 384.9 Joback Calculated Property
η 0.00 Pa×s 384.9 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-CH2- 2
-CH3 2
O=CH- (aldehyde) 1

Similar Compounds

Pentanal, 2-methyl-. Hexanal, 4-methyl-. Hexanal, 5-methyl-. Pentanal. Pentanal, 3-methyl-. 3,4-Dimethylpentanal. 2-Hexanone, 5-methyl-. 6-Methylheptanal. 6-Methylheptanal. Hexanal. Butanal, 3-methyl-. Glutaraldehyde. 8-METHYLNONANAL. 13-Methyltetradecanal. 12-methyltridecanal.

Find more compounds similar to Pentanal, 4-methyl-.

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.