Chemical Properties of Octanoic acid, 4,6-dimethyl-, methyl ester, (4S,6S)-(+)- (CAS 2553-96-0)

Octanoic acid, 4,6-dimethyl-, methyl ester, (4S,6S)-(+)-

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InChI
InChI=1S/C11H22O2/c1-5-9(2)8-10(3)6-7-11(12)13-4/h9-10H,5-8H2,1-4H3/t9-,10-/m1/s1
InChI Key
BGVRQMVRIJKKDZ-NXEZZACHSA-N
Formula
C11H22O2
SMILES
CCC(C)CC(C)CCC(=O)OC
Molecular Weight1
186.29
CAS
2553-96-0
Other Names
  • Methyl 4,6-dimethyloctanoate
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Physical Properties

Property Value Unit Source
Δf -197.06 kJ/mol Joback Calculated Property
Δfgas -525.73 kJ/mol Joback Calculated Property
Δfus 19.99 kJ/mol Joback Calculated Property
Δvap 48.46 kJ/mol Joback Calculated Property
log10WS -2.81 Crippen Calculated Property
logPoct/wat 3.012 Crippen Calculated Property
McVol 173.290 ml/mol McGowan Calculated Property
Pc 2043.76 kPa Joback Calculated Property
Tboil 526.49 K Joback Calculated Property
Tc 704.16 K Joback Calculated Property
Tfus 255.89 K Joback Calculated Property
Vc 0.663 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [415.72; 500.43] J/mol×K [526.49; 704.16] Show Hide
Cp,gas 415.72 J/mol×K 526.49 Joback Calculated Property
Cp,gas 431.38 J/mol×K 556.10 Joback Calculated Property
Cp,gas 446.42 J/mol×K 585.71 Joback Calculated Property
Cp,gas 460.84 J/mol×K 615.32 Joback Calculated Property
Cp,gas 474.64 J/mol×K 644.93 Joback Calculated Property
Cp,gas 487.83 J/mol×K 674.54 Joback Calculated Property
Cp,gas 500.43 J/mol×K 704.16 Joback Calculated Property
η [0.0001825; 0.0066509] Pa×s [255.89; 526.49] Show Hide
η 0.0066509 Pa×s 255.89 Joback Calculated Property
η 0.0023315 Pa×s 300.99 Joback Calculated Property
η 0.0010741 Pa×s 346.09 Joback Calculated Property
η 0.0005917 Pa×s 391.19 Joback Calculated Property
η 0.0003687 Pa×s 436.29 Joback Calculated Property
η 0.0002510 Pa×s 481.39 Joback Calculated Property
η 0.0001825 Pa×s 526.49 Joback Calculated Property

Similar Compounds

Nonanoic acid, 4,6-dimethyl-, methyl ester. 4-Methyldecanoic acid, methyl ester. Octanoic acid, 4-methyl-, methyl ester. Methyl 4-methylnonanoate. Octadecanoic acid, 4-methyl-, methyl ester. 4-Methylheptanoic acid, methyl ester. Heptanedioic acid, 4-methyl-, dimethyl ester. Hexanoic acid, 4-methyl-, methyl ester. Octadecanoic acid, 16-methyl-, methyl ester. Pentadecanoic acid, 13-methyl-, methyl ester. Dodecanoic acid, 10-methyl-, methyl ester. Hexadecanoic acid, 14-methyl-, methyl ester. Heptadecanoic acid, 15-methyl-, methyl ester. Methyl 7-Methylnonanoate. Methyl 6-methyloctanoate.

Find more compounds similar to Octanoic acid, 4,6-dimethyl-, methyl ester, (4S,6S)-(+)-.

Sources

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