Chemical Properties of 5-Bromovaleric acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester

5-Bromovaleric acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester

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InChI
InChI=1S/C15H23BrO2/c1-12(2)8-9-14(11-13(3)4)18-15(17)7-5-6-10-16/h13-14H,1,5-7,10-11H2,2-4H3
InChI Key
WWHSZPVJDMJJRF-UHFFFAOYSA-N
Formula
C15H23BrO2
SMILES
C=C(C)C#CC(CC(C)C)OC(=O)CCCCBr
Molecular Weight1
315.25
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Physical Properties

Property Value Unit Source
Δf 133.03 kJ/mol Joback Calculated Property
Δfgas -194.02 kJ/mol Joback Calculated Property
Δfus 36.16 kJ/mol Joback Calculated Property
Δvap 65.36 kJ/mol Joback Calculated Property
log10WS -4.91 Crippen Calculated Property
logPoct/wat 4.089 Crippen Calculated Property
McVol 234.250 ml/mol McGowan Calculated Property
Pc 1857.91 kPa Joback Calculated Property
Inp 1835.50 NIST
Tboil 689.73 K Joback Calculated Property
Tc 896.49 K Joback Calculated Property
Tfus 451.15 K Joback Calculated Property
Vc 0.893 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [605.62; 689.43] J/mol×K [689.73; 896.49] Show Hide
Cp,gas 605.62 J/mol×K 689.73 Joback Calculated Property
Cp,gas 621.73 J/mol×K 724.19 Joback Calculated Property
Cp,gas 636.95 J/mol×K 758.65 Joback Calculated Property
Cp,gas 651.29 J/mol×K 793.11 Joback Calculated Property
Cp,gas 664.80 J/mol×K 827.57 Joback Calculated Property
Cp,gas 677.50 J/mol×K 862.03 Joback Calculated Property
Cp,gas 689.43 J/mol×K 896.49 Joback Calculated Property

Similar Compounds

6-Bromohexanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 4-Bromobutanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Valeric acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Glutaric acid, di(2,7-dimethyloct-5-yn-7-en-4-yl) ester. Butanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Hexanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 5-Chlorovaleric acid, 2,7-dimethylocty-7-en-5-yn-4-yl ester. Sebacic acid, di(2,7-dimethylocta-7-en-5-yn-4-yl) ester. Octanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 5-Bromovaleric acid, 2-methyloct-5-yn-4-yl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl propyl ester. Undec-10-ynoic acid, 2,7-dimethyloct-1-en-3-yn-5-yl ester. Glutaric acid, butyl 2,7-dimethyloct-5-yn-7-en-4-yl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl pentyl ester. Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl isobutyl ester.

Find more compounds similar to 5-Bromovaleric acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester.

Sources

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