Chemical Properties of 6-Bromohexanoic acid, hex-4-yn-3-yl ester

6-Bromohexanoic acid, hex-4-yn-3-yl ester

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InChI
InChI=1S/C12H19BrO2/c1-3-8-11(4-2)15-12(14)9-6-5-7-10-13/h11H,4-7,9-10H2,1-2H3
InChI Key
JRYXFDQXWHHUQM-UHFFFAOYSA-N
Formula
C12H19BrO2
SMILES
CC#CC(CC)OC(=O)CCCCCBr
Molecular Weight1
275.18
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Physical Properties

Property Value Unit Source
Δf 30.92 kJ/mol Joback Calculated Property
Δfgas -242.46 kJ/mol Joback Calculated Property
Δfus 34.51 kJ/mol Joback Calculated Property
Δvap 59.66 kJ/mol Joback Calculated Property
log10WS -4.05 Crippen Calculated Property
logPoct/wat 3.287 Crippen Calculated Property
McVol 196.280 ml/mol McGowan Calculated Property
Pc 2295.91 kPa Joback Calculated Property
Inp 1663.00 NIST
Tboil 624.97 K Joback Calculated Property
Tc 829.86 K Joback Calculated Property
Tfus 448.06 K Joback Calculated Property
Vc 0.750 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [472.16; 548.88] J/mol×K [624.97; 829.86] Show Hide
Cp,gas 472.16 J/mol×K 624.97 Joback Calculated Property
Cp,gas 486.76 J/mol×K 659.12 Joback Calculated Property
Cp,gas 500.61 J/mol×K 693.27 Joback Calculated Property
Cp,gas 513.73 J/mol×K 727.42 Joback Calculated Property
Cp,gas 526.14 J/mol×K 761.57 Joback Calculated Property
Cp,gas 537.84 J/mol×K 795.71 Joback Calculated Property
Cp,gas 548.88 J/mol×K 829.86 Joback Calculated Property

Similar Compounds

5-Bromovaleric acid, hex-4-yn-3-yl ester. Hexanoic acid, hex-4-yn-3-yl ester. Sebacic acid, di(hex-4-yn-3-yl) ester. Octanoic acid, hex-4-yn-3-yl ester. Undec-10-ynoic acid, hex-4-yn-3-yl ester. Sebacic acid, hex-4-yn-3-yl propyl ester. Valeric acid, hex-4-yn-3-yl ester. Glutaric acid, hept-2-yl hex-4-yn-3-yl ester. Glutaric acid, dec-2-yl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl hexyl ester. Glutaric acid, heptyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl 2-hexyl ester. 4-Bromobutanoic acid, hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl hexadecyl ester. Glutaric acid, hex-4-yn-3-yl undecyl ester.

Find more compounds similar to 6-Bromohexanoic acid, hex-4-yn-3-yl ester.

Sources

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