Chemical Properties of Sarcosine, N-(4-bromobenzoyl)-, octyl ester

Sarcosine, N-(4-bromobenzoyl)-, octyl ester

InChI
InChI=1S/C18H26BrNO3/c1-3-4-5-6-7-8-13-23-17(21)14-20(2)18(22)15-9-11-16(19)12-10-15/h9-12H,3-8,13-14H2,1-2H3
InChI Key
ABCWLUUEOCOVOE-UHFFFAOYSA-N
Formula
C18H26BrNO3
SMILES
CCCCCCCCOC(=O)CN(C)C(=O)c1ccc(Br)cc1
Molecular Weight1
384.31
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° 50.30 kJ/mol Joback Calculated Property
ΔvapH° 105.36 kJ/mol Relay (1.0) Calculated Property
log10WS -5.37 Relay (1.0) Calculated Property
logPoct/wat 4.425 Crippen Calculated Property
McVol 277.210 ml/mol McGowan Calculated Property
Pc 1606.42 kPa Joback Calculated Property
Inp 2682.00 NIST
Tboil 658.94 K Relay (1.0) Calculated Property
Tfus 313.82 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [809.58; 882.33] J/mol×K [833.79; 1040.83] Show Hide
Cp,gas 809.58 J/mol×K 833.79 Joback Calculated Property
Cp,gas 824.19 J/mol×K 868.30 Joback Calculated Property
Cp,gas 837.74 J/mol×K 902.80 Joback Calculated Property
Cp,gas 850.27 J/mol×K 937.31 Joback Calculated Property
Cp,gas 861.85 J/mol×K 971.82 Joback Calculated Property
Cp,gas 872.52 J/mol×K 1006.32 Joback Calculated Property
Cp,gas 882.33 J/mol×K 1040.83 Joback Calculated Property

Similar Compounds

Sarcosine, N-(4-bromobenzoyl)-, dodecyl ester. Sarcosine, N-(4-bromobenzoyl)-, nonyl ester. Sarcosine, N-(4-bromobenzoyl)-, heptyl ester. Sarcosine, N-(4-bromobenzoyl)-, decyl ester. Sarcosine, N-(4-bromobenzoyl)-, undecyl ester. Sarcosine, N-(4-bromobenzoyl)-, hexyl ester. Sarcosine, N-(4-bromobenzoyl)-, pentyl ester. Sarcosine, N-(4-bromobenzoyl)-, isohexyl ester. Sarcosine, N-(4-bromobenzoyl)-, butyl ester. Sarcosine, N-(4-methylbenzoyl)-, tetradecyl ester. Sarcosine, N-(4-methylbenzoyl)-, dodecyl ester. Sarcosine, N-(4-methylbenzoyl)-, nonyl ester. Sarcosine, N-(4-methylbenzoyl)-, undecyl ester. Sarcosine, N-(4-methylbenzoyl)-, pentadecyl ester. Sarcosine, N-(4-methylbenzoyl)-, octyl ester.

Find more compounds similar to Sarcosine, N-(4-bromobenzoyl)-, octyl 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.