Chemical Properties of 3,6-Dimethyl-1-heptyn-3-ol (CAS 19549-98-5)

3,6-Dimethyl-1-heptyn-3-ol

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InChI
InChI=1S/C9H16O/c1-5-9(4,10)7-6-8(2)3/h1,8,10H,6-7H2,2-4H3
InChI Key
COWFALGRNJAHKW-UHFFFAOYSA-N
Formula
C9H16O
SMILES
C#CC(C)(O)CCC(C)C
Molecular Weight1
140.22
CAS
19549-98-5
Other Names
  • 1-Heptyn-3-ol, 3,6-dimethyl-
Sources

Physical Properties

Property Value Unit Source
Δf 111.55 kJ/mol Joback Calculated Property
Δfgas -103.45 kJ/mol Joback Calculated Property
Δfus 15.19 kJ/mol Joback Calculated Property
Δvap 50.48 kJ/mol Joback Calculated Property
logPoct/wat 1.807 Crippen Calculated Property
Pc 3035.62 kPa Joback Calculated Property
Tboil 332.50 ± 0.50 K NIST
Tc 666.13 K Joback Calculated Property
Tfus 286.40 K Joback Calculated Property
Vc 0.503 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 303.93 J/mol×K 483.95 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-OH (alcohol) 1
#C- 1
-CH2- 2
>C< 1
#CH 1
-CH3 3

Similar Compounds

3-Methyl-1-nonyne-3-ol. 1-Hexyn-3-ol, 3-methyl-. 1-Dodecyn-3-ol, 3,7,11-trimethyl. 1-Hexadodecyn-3-ol, 3,7,11,15-trimethyl-. 4-Methyl-2-octyn-4-ol. 1-Ethynylcyclopentanol. Cyclohexanol, 1-ethynyl-. 1-Hydroxy-1-ethynylcyclododecane. 1-Ethynyl-1-cyclooctanol. 1-Ethynyl-1-cycloheptanol. 1-Hexyn-3-ol, 3,5-dimethyl-. Cyclobutyl ethynyl methyl carbinol. 3-Ethyl-5-methyl-1-heptyn-3-ol. 3-Methyl-6-hepten-1-yn-3-ol. 2-Hexanol, 2,5-dimethyl-.

Find more compounds similar to 3,6-Dimethyl-1-heptyn-3-ol.

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