Chemical Properties of 2-Heptyn-4-ol

2-Heptyn-4-ol

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InChI
InChI=1S/C7H12O/c1-3-5-7(8)6-4-2/h7-8H,3,5H2,1-2H3
InChI Key
AYFRKLSJSAVMRG-UHFFFAOYSA-N
Formula
C7H12O
SMILES
CC#CC(O)CCC
Molecular Weight1
112.17
Sources

Physical Properties

Property Value Unit Source
Δf 71.60 kJ/mol Joback Calculated Property
Δfgas -73.02 kJ/mol Joback Calculated Property
Δfus 17.57 kJ/mol Joback Calculated Property
Δvap 49.62 kJ/mol Joback Calculated Property
logPoct/wat 1.171 Crippen Calculated Property
Pc 3763.78 kPa Joback Calculated Property
Tboil 460.30 K Joback Calculated Property
Tc 645.47 K Joback Calculated Property
Tfus 320.57 K Joback Calculated Property
Vc 0.403 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 217.62 J/mol×K 460.3 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
#C- 2
-OH (alcohol) 1
-CH3 2
-CH2- 2

Similar Compounds

4-Heptyn-3-ol. 4-Hexyn-3-ol. 2-Methyl-5-octyn-4-ol. 1-Hexyn-3-ol. Dodec-5-yne-1,4-diol. 4-Methyl-2-heptyn-4-ol. 1-Heptyn-3-ol. 5-Methyl-1-hexyn-3-ol. 2-Heptyn-1-ol. 5-Octyn-3-ol. 3-Decyn-2-ol. 1-Octyn-3-ol. 3-Methyl-4-hexyn-3-ol. 4-Methyl-2-octyn-4-ol. 1-Pentyn-3-ol.

Find more compounds similar to 2-Heptyn-4-ol.

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