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

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

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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
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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

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