Chemical Properties of Benzoic acid, 3-(neopentyl)oxy-, methyl ester

Benzoic acid, 3-(neopentyl)oxy-, methyl ester

PDF Excel Molecule Calculator
InChI
InChI=1S/C13H18O3/c1-13(2,3)9-16-11-7-5-6-10(8-11)12(14)15-4/h5-8H,9H2,1-4H3
InChI Key
DMMBVVKUHXTPGH-UHFFFAOYSA-N
Formula
C13H18O3
SMILES
COC(=O)c1cccc(OCC(C)(C)C)c1
Molecular Weight1
222.28
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 -174.72 kJ/mol Joback Calculated Property
Δfgas -472.36 kJ/mol Joback Calculated Property
Δfus 19.64 kJ/mol Joback Calculated Property
Δvap 57.74 kJ/mol Joback Calculated Property
log10WS -3.27 Crippen Calculated Property
logPoct/wat 2.898 Crippen Calculated Property
McVol 183.580 ml/mol McGowan Calculated Property
Pc 2263.26 kPa Joback Calculated Property
Inp [1605.00; 1605.00]   Show Hide
Inp 1605.00 NIST
Inp 1605.00 NIST
Tboil 623.98 K Joback Calculated Property
Tc 837.28 K Joback Calculated Property
Tfus 372.02 K Joback Calculated Property
Vc 0.686 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [472.53; 554.30] J/mol×K [623.98; 837.28] Show Hide
Cp,gas 472.53 J/mol×K 623.98 Joback Calculated Property
Cp,gas 488.51 J/mol×K 659.53 Joback Calculated Property
Cp,gas 503.52 J/mol×K 695.08 Joback Calculated Property
Cp,gas 517.57 J/mol×K 730.63 Joback Calculated Property
Cp,gas 530.70 J/mol×K 766.18 Joback Calculated Property
Cp,gas 542.93 J/mol×K 801.73 Joback Calculated Property
Cp,gas 554.30 J/mol×K 837.28 Joback Calculated Property
η [0.0001151; 0.0013196] Pa×s [372.02; 623.98] Show Hide
η 0.0013196 Pa×s 372.02 Joback Calculated Property
η 0.0007150 Pa×s 414.01 Joback Calculated Property
η 0.0004337 Pa×s 456.01 Joback Calculated Property
η 0.0002862 Pa×s 498.00 Joback Calculated Property
η 0.0002015 Pa×s 539.99 Joback Calculated Property
η 0.0001492 Pa×s 581.99 Joback Calculated Property
η 0.0001151 Pa×s 623.98 Joback Calculated Property

Similar Compounds

Benzoic acid, 3-(2-methylpropyl)oxy-, methyl ester. Benzoic acid, 3-propyloxy-, methyl ester. Benzoic acid, 3-butyloxy-, methyl ester. Benzoic acid, 3-ethoxy-, methyl ester. Benzoic acid, 3-(2-methylpropyl)oxy-, 2-methylpropyl ester. Benzoic acid, 4-(neopentyl)oxy-, methyl ester. Benzoic acid, 3-(2-methylbutyl)oxy-, methyl ester. Benzoic acid, 3-pentyloxy-, methyl ester. Benzoic acid, 3-propyloxy-, propyl ester. Benzoic acid, 3-(3-methylbutyl)oxy-, methyl ester. 3-Isopropoxybenzoic acid, methyl ester. Benzoic acid, 3-(1-methylpropyl)oxy-, methyl ester. Benzoic acid, 3-methoxy-, methyl ester. Benzoic acid, 3-ethyloxy-, ethyl ester. Benzoic acid, 4-(2-methylpropyl)oxy-, methyl ester.

Find more compounds similar to Benzoic acid, 3-(neopentyl)oxy-, methyl 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.