Chemical Properties of Novalal

Novalal

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InChI
InChI=1S/C9H14O/c1-8(2)9(3)6-4-5-7-10/h4-5,7-8H,3,6H2,1-2H3/b5-4-
InChI Key
HVROQZAOTSHMKE-PLNGDYQASA-N
Formula
C9H14O
SMILES
C=C(CC=CC=O)C(C)C
Molecular Weight1
138.21
Sources

Physical Properties

Property Value Unit Source
Δf 82.45 kJ/mol Joback Calculated Property
Δfgas -87.09 kJ/mol Joback Calculated Property
Δfus 15.44 kJ/mol Joback Calculated Property
Δvap 41.33 kJ/mol Joback Calculated Property
logPoct/wat 2.34 Crippen Calculated Property
Pc 2767.17 kPa Joback Calculated Property
Tboil 454.26 K Joback Calculated Property
Tc 643.08 K Joback Calculated Property
Tfus 197.39 K Joback Calculated Property
Vc 0.51 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 265.91 J/mol×K 454.26 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

cis-2-methyl-3-methylenehept-5-ene. Salvene. (E)-Salvene. cis-Salvene. trans-Salvene. (Z)-Salvene. Isonovalal. Novalic acid. 3-Octen-2-one, 7-methyl-. 2,6-dimethyl-2-heptenal. 1,3-Cyclopentadiene, 1-(1-methylethyl). 2-Heptenal, (E)-. 2-Heptenal, (Z)-. 2-Heptenal. (Z)-2-octenal.

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