Chemical Properties of Benzoic acid, 3-(methylthio)-, 3-methylbutyl ester

Benzoic acid, 3-(methylthio)-, 3-methylbutyl ester

PDF Excel Molecule Calculator
InChI
InChI=1S/C13H18O2S/c1-10(2)7-8-15-13(14)11-5-4-6-12(9-11)16-3/h4-6,9-10H,7-8H2,1-3H3
InChI Key
HZHZKPNBFCNQSI-UHFFFAOYSA-N
Formula
C13H18O2S
SMILES
CSc1cccc(C(=O)OCCC(C)C)c1
Molecular Weight1
238.35
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
Δf -41.88 kJ/mol Joback Calculated Property
Δfgas -294.80 kJ/mol Joback Calculated Property
Δfus 26.47 kJ/mol Joback Calculated Property
Δvap 63.06 kJ/mol Joback Calculated Property
log10WS -3.89 Crippen Calculated Property
logPoct/wat 3.611 Crippen Calculated Property
McVol 194.060 ml/mol McGowan Calculated Property
Pc 2313.61 kPa Joback Calculated Property
Inp 1878.00 NIST
Tboil 673.13 K Joback Calculated Property
Tc 897.16 K Joback Calculated Property
Tfus 366.77 K Joback Calculated Property
Vc 0.728 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [499.83; 578.59] J/mol×K [673.13; 897.16] Show Hide
Cp,gas 499.83 J/mol×K 673.13 Joback Calculated Property
Cp,gas 515.48 J/mol×K 710.47 Joback Calculated Property
Cp,gas 530.10 J/mol×K 747.81 Joback Calculated Property
Cp,gas 543.70 J/mol×K 785.14 Joback Calculated Property
Cp,gas 556.31 J/mol×K 822.48 Joback Calculated Property
Cp,gas 567.93 J/mol×K 859.82 Joback Calculated Property
Cp,gas 578.59 J/mol×K 897.16 Joback Calculated Property

Similar Compounds

Benzoic acid, 3-(methylthio)-, butyl ester. Benzoic acid, 3-(methylthio)-, 2-methylbutyl ester. Benzoic acid, 3-(methylthio)-, pentyl ester. Benzoic acid, 3-(3-methylbutyl)thio-, 3-methylbutyl ester. Benzoic acid, 4-(methylthio)-, 3-methylbutyl ester. Benzoic acid, 2-(methylthio)-, 3-methylbutyl ester. 3-(Methylthio)benzoic acid, 2-propylpentyl ester. Benzoic acid, 3-(methylthio)-, propyl ester. Benzoic acid, 3-(methylthio)-, 2-methylpropyl ester. Benzoic acid, 3-(butylthio)-, butyl ester. Benzoic acid, 3-(methylthio)-, 1-methylpropyl ester. Benzoic acid, 2-(methylthio)-, butyl ester. Benzoic acid, 4-(3-methylbutyl)thio-, 3-methylbutyl ester. Benzoic acid, 3-(2-methylbutyl)thio-, 2-methylbutyl ester. Benzoic acid, 3-(propylthio)-, propyl ester.

Find more compounds similar to Benzoic acid, 3-(methylthio)-, 3-methylbutyl 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.