Chemical Properties of 4-Bromobutanoic acid, hex-4-yn-3-yl ester

4-Bromobutanoic acid, hex-4-yn-3-yl ester

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InChI
InChI=1S/C10H15BrO2/c1-3-6-9(4-2)13-10(12)7-5-8-11/h9H,4-5,7-8H2,1-2H3
InChI Key
FFPLKCIMJWWPHZ-UHFFFAOYSA-N
Formula
C10H15BrO2
SMILES
CC#CC(CC)OC(=O)CCCBr
Molecular Weight1
247.13
Sources

Physical Properties

Property Value Unit Source
Δf 14.08 kJ/mol Joback Calculated Property
Δfgas -201.18 kJ/mol Joback Calculated Property
Δfus 29.33 kJ/mol Joback Calculated Property
Δvap 55.21 kJ/mol Joback Calculated Property
logPoct/wat 2.51 Crippen Calculated Property
Pc 2784.72 kPa Joback Calculated Property
Tboil 579.21 K Joback Calculated Property
Tc 790.63 K Joback Calculated Property
Tfus 425.52 K Joback Calculated Property
Vc 0.64 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 375.02 J/mol×K 579.21 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>CH- 1
-CH3 2
#C- 2
-CH2- 4
>C=O (nonring) 1
-Br 1

Similar Compounds

Butanoic acid, hex-4-yn-3-yl ester. 5-Bromovaleric acid, hex-4-yn-3-yl ester. Valeric acid, hex-4-yn-3-yl ester. 6-Bromohexanoic acid, hex-4-yn-3-yl ester. Hexanoic acid, hex-4-yn-3-yl ester. Glutaric acid, but-3-yn-2-yl hex-4-yn-3-yl ester. Glutaric acid, ethyl hex-4-yn-3-yl ester. Glutaric acid, di(hex-4-yn-3-yl) ester. Glutaric acid, hex-4-yn-3-yl propyl ester. Glutaric acid, hex-4-yn-3-yl isopropyl ester. 4-Bromobutanoic acid, 2-methyl-5-yn-4-yl ester. 5-Chlorovaleric acid, hex-4-yn-3-yl ester. Glutaric acid, butyl hex-4-yn-3-yl ester. Octanoic acid, hex-4-yn-3-yl ester. Sebacic acid, di(hex-4-yn-3-yl) ester.

Find more compounds similar to 4-Bromobutanoic acid, hex-4-yn-3-yl ester.

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