Chemical Properties of Cyclopropanecarboxylic acid, 2-methyloct-5-yn-4-yl ester

Cyclopropanecarboxylic acid, 2-methyloct-5-yn-4-yl ester

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InChI
InChI=1S/C13H20O2/c1-4-5-6-12(9-10(2)3)15-13(14)11-7-8-11/h10-12H,4,7-9H2,1-3H3
InChI Key
LELZXSOBOUZPNC-UHFFFAOYSA-N
Formula
C13H20O2
SMILES
CCC#CC(CC(C)C)OC(=O)C1CC1
Molecular Weight1
208.30
Sources

Physical Properties

Property Value Unit Source
Δf 83.33 kJ/mol Joback Calculated Property
Δfgas -221.91 kJ/mol Joback Calculated Property
Δfus 26.42 kJ/mol Joback Calculated Property
Δvap 54.98 kJ/mol Joback Calculated Property
logPoct/wat 2.77 Crippen Calculated Property
Pc 2237.64 kPa Joback Calculated Property
Tboil 587.99 K Joback Calculated Property
Tc 795.45 K Joback Calculated Property
Tfus 402.47 K Joback Calculated Property
Vc 0.69 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 464.26 J/mol×K 587.99 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 1
-CH3 3
#C- 2
-CH2- 2
>C=O (nonring) 1
>CH- (ring) 1
-CH2- (ring) 2

Similar Compounds

2,2-Dimethylpropanoic acid, 2-methyloct-5-yn-4-yl ester. Butanoic acid, 2-methyloct-5-yn-4-yl ester. Cyclopropanecarboxylic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Valeric acid, 2-methyloct-5-yn-4-yl ester. Cyclobutanecarboxylic acid, 2-methyloct-5-yn-4-yl ester. 4-Bromobutanoic acid, 2-methyl-5-yn-4-yl ester. Cyclopropanecarboxylic acid, hex-4-yn-3-yl ester. Glutaric acid, isobutyl 2-methyloct-5-yn-4-yl ester. Hexanoic acid, 2-methyloct-5-yn-4-yl ester. Sebacic acid, isobutyl 2-methyloct-5-yn-4-yl ester. Glutaric acid, 3-methylbut-2-yl 2-methyloct-5-yn-4-yl ester. Glutaric acid, 2-methyloct-5-yn-4-yl propyl ester. Glutaric acid, di(2-methyloct-5-yn-4-yl) ester. Glutaric acid, butyl 2-methyloct-5-yn-4-yl ester. Sebacic acid, 2-methyloct-5-yn-4-yl propyl ester.

Find more compounds similar to Cyclopropanecarboxylic acid, 2-methyloct-5-yn-4-yl ester.

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