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
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

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

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [307.09; 364.48] J/mol×K [524.18; 730.48] Show Hide
Cp,gas 307.09 J/mol×K 524.18 Joback Calculated Property
Cp,gas 318.25 J/mol×K 558.56 Joback Calculated Property
Cp,gas 328.73 J/mol×K 592.95 Joback Calculated Property
Cp,gas 338.56 J/mol×K 627.33 Joback Calculated Property
Cp,gas 347.77 J/mol×K 661.71 Joback Calculated Property
Cp,gas 356.40 J/mol×K 696.10 Joback Calculated Property
Cp,gas 364.48 J/mol×K 730.48 Joback 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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.