Chemical Properties of 6-Bromohexanoic acid, but-3-yn-2-yl ester

6-Bromohexanoic acid, but-3-yn-2-yl ester

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InChI
InChI=1S/C10H15BrO2/c1-3-9(2)13-10(12)7-5-4-6-8-11/h1,9H,4-8H2,2H3
InChI Key
XLDQEPUOOPFDOQ-UHFFFAOYSA-N
Formula
C10H15BrO2
SMILES
C#CC(C)OC(=O)CCCCCBr
Molecular Weight1
247.13
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Physical Properties

Property Value Unit Source
Δf 34.35 kJ/mol Joback Calculated Property
Δfgas -181.58 kJ/mol Joback Calculated Property
Δfus 29.18 kJ/mol Joback Calculated Property
Δvap 52.92 kJ/mol Joback Calculated Property
log10WS -3.21 Crippen Calculated Property
logPoct/wat 2.507 Crippen Calculated Property
McVol 168.100 ml/mol McGowan Calculated Property
Pc 2749.78 kPa Joback Calculated Property
Inp [1428.00; 1428.00]   Show Hide
Inp 1428.00 NIST
Inp 1428.00 NIST
Tboil 560.33 K Joback Calculated Property
Tc 761.57 K Joback Calculated Property
Tfus 366.39 K Joback Calculated Property
Vc 0.637 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [374.52; 440.95] J/mol×K [560.33; 761.57] Show Hide
Cp,gas 374.52 J/mol×K 560.33 Joback Calculated Property
Cp,gas 387.15 J/mol×K 593.87 Joback Calculated Property
Cp,gas 399.13 J/mol×K 627.41 Joback Calculated Property
Cp,gas 410.48 J/mol×K 660.95 Joback Calculated Property
Cp,gas 421.22 J/mol×K 694.49 Joback Calculated Property
Cp,gas 431.37 J/mol×K 728.03 Joback Calculated Property
Cp,gas 440.95 J/mol×K 761.57 Joback Calculated Property

Similar Compounds

5-Bromovaleric acid, but-3-yn-2-yl ester. Sebacic acid, di(but-3-yn-2-yl) ester. Hexanoic acid, but-3-yn-2-yl ester. Octanoic acid, but-3-yn-2-yl ester. Undec-10-ynoic acid, but-3-yn-2-yl ester. Valeric acid, but-3-yn-2-yl ester. 6-Bromohexanoic acid, hex-4-yn-3-yl ester. 4-Bromobutanoic acid, but-3-yn-2-yl ester. Ethyl 6-bromohexanoate. Sebacic acid, but-3-yn-2-yl propyl ester. Glutaric acid, di(but-3-yn-2-yl) ester. 3-Cyclopentylpropionic acid, but-3-yn-2-yl ester. 5-Bromovaleric acid, hex-4-yn-3-yl ester. Sebacic acid, butyl but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl hexyl ester.

Find more compounds similar to 6-Bromohexanoic acid, but-3-yn-2-yl ester.

Sources

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