Chemical Properties of Hexanoic acid, 1-methylbutyl ester (CAS 88164-61-8)

Hexanoic acid, 1-methylbutyl ester

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InChI
InChI=1S/C11H22O2/c1-4-6-7-9-11(12)13-10(3)8-5-2/h10H,4-9H2,1-3H3
InChI Key
LDSKHRQOZJYTFX-UHFFFAOYSA-N
Formula
C11H22O2
SMILES
CCCCCC(=O)OC(C)CCC
Molecular Weight1
186.29
CAS
88164-61-8
Other Names
  • 2-pentyl hexanoate
  • isopentyl hexanoate
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Physical Properties

Property Value Unit Source
Δf -194.62 kJ/mol Joback Calculated Property
Δfgas -520.45 kJ/mol Joback Calculated Property
Δfus 23.51 kJ/mol Joback Calculated Property
Δvap 48.85 kJ/mol Joback Calculated Property
log10WS -3.40 Crippen Calculated Property
logPoct/wat 3.298 Crippen Calculated Property
McVol 173.290 ml/mol McGowan Calculated Property
Pc 2029.06 kPa Joback Calculated Property
I [1397.00; 1407.00]   Show Hide
I 1407.00 NIST
I 1397.00 NIST
I 1407.00 NIST
Tboil 526.93 K Joback Calculated Property
Tc 701.19 K Joback Calculated Property
Tfus 270.89 K Joback Calculated Property
Vc 0.669 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [415.48; 498.48] J/mol×K [526.93; 701.19] Show Hide
Cp,gas 415.48 J/mol×K 526.93 Joback Calculated Property
Cp,gas 430.78 J/mol×K 555.97 Joback Calculated Property
Cp,gas 445.49 J/mol×K 585.02 Joback Calculated Property
Cp,gas 459.60 J/mol×K 614.06 Joback Calculated Property
Cp,gas 473.13 J/mol×K 643.11 Joback Calculated Property
Cp,gas 486.09 J/mol×K 672.15 Joback Calculated Property
Cp,gas 498.48 J/mol×K 701.19 Joback Calculated Property
η [0.0001937; 0.0044896] Pa×s [270.89; 526.93] Show Hide
η 0.0044896 Pa×s 270.89 Joback Calculated Property
η 0.0018616 Pa×s 313.56 Joback Calculated Property
η 0.0009531 Pa×s 356.24 Joback Calculated Property
η 0.0005632 Pa×s 398.91 Joback Calculated Property
η 0.0003684 Pa×s 441.58 Joback Calculated Property
η 0.0002597 Pa×s 484.26 Joback Calculated Property
η 0.0001937 Pa×s 526.93 Joback Calculated Property

Similar Compounds

Pimelic acid, di(2-pentyl) ester. 2-Pentyl dodecanoate. Octanoic acid, 2-pentyl ester. Nonanoic acid, 2-pentyl ester. di-(1-Ethylpentyl)pimelate. Hexanoic acid, 1-methylhexyl ester. 2-Heptanol, pentanoate. Adipic acid, di(2-heptyl) ester. Sebacic acid, di(2-hexyl) ester. 2-nonyl hexanoate. 2-Hexyl heptadecanoate. Pentanoic acid, 2-pentyl ester. di-(1-Methylhexyl)pimelate. Pentanoic acid, 2-octyl ester. di-(1-Methylhexyl)suberate.

Find more compounds similar to Hexanoic acid, 1-methylbutyl ester.

Sources

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