Chemical Properties of 4-Bromobutanoic acid, pent-2-en-4-ynyl ester

4-Bromobutanoic acid, pent-2-en-4-ynyl ester

InChI
InChI=1S/C9H11BrO2/c1-2-3-4-8-12-9(11)6-5-7-10/h1,3-4H,5-8H2
InChI Key
DBHFYGRAUDTJAT-UHFFFAOYSA-N
Formula
C9H11BrO2
SMILES
C#CC=CCOC(=O)CCCBr
Molecular Weight1
231.09
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Physical Properties

Property Value Unit Source
ΔfusH° 31.90 kJ/mol Joback Calculated Property
logPoct/wat 1.894 Crippen Calculated Property
McVol 149.710 ml/mol McGowan Calculated Property
Inp [1413.00; 1413.00]   Show Hide
Inp 1413.00 NIST
Inp 1413.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [201.54; 412.56] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A2.79040e+01
Coefficient B7.68300e-01
Coefficient C-5.22330e-04
Coefficient D1.38690e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 201.54 J/mol×K 273.00 Calculated Property
Cp,gas 240.48 J/mol×K 353.78 Calculated Property
Cp,gas 274.52 J/mol×K 434.56 Calculated Property
Cp,gas 304.10 J/mol×K 515.33 Calculated Property
Cp,gas 329.67 J/mol×K 596.11 Calculated Property
Cp,gas 351.65 J/mol×K 676.89 Calculated Property
Cp,gas 370.49 J/mol×K 757.67 Calculated Property
Cp,gas 386.63 J/mol×K 838.44 Calculated Property
Cp,gas 400.51 J/mol×K 919.22 Calculated Property
Cp,gas 412.56 J/mol×K 1000.00 Calculated Property

Similar Compounds

Butanoic acid, pent-2-en-4-ynyl ester. 5-Bromovaleric acid, pent-2-en-4-ynyl ester. 6-Bromohexanoic acid, pent-2-en-4-ynyl ester. valeric acid, pent-2-en-4-ynyl ester. 4-Bromobutanoic acid, 3-chloroprop-2-enyl ester. Hexanoic acid, pent-2-en-4-ynyl ester. Octanoic acid, pent-2-en-4-ynyl ester. 4-Bromobutanoic acid, 3-methylbut-2-enyl ester. 5-Chlorovaleric acid, pent-2-en-4-ynyl ester. Cyclopropanecarboxylic acid, pent-2-en-4-ynyl ester. (E,Z)-2,8-Decadien-4,6-diyn-1-yl 3-methylbutanoate. 3-Cyclopentylpropionic acid, pent-2-en-4-ynyl ester. 4-Bromobutanoic acid, undec-2-enyl ester. Cyclobutanecarboxylic acid, pent-2-en-4-ynyl ester. 5-Bromovaleric acid, 3-chloroprop-2-enyl ester.

Find more compounds similar to 4-Bromobutanoic acid, pent-2-en-4-ynyl ester.

Sources

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