Chemical Properties of 4-Methylhexyl 3-methylbutanoate (CAS 1215127-80-2)

4-Methylhexyl 3-methylbutanoate

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InChI
InChI=1S/C12H24O2/c1-5-11(4)7-6-8-14-12(13)9-10(2)3/h10-11H,5-9H2,1-4H3
InChI Key
KQLITBHOONUXEL-UHFFFAOYSA-N
Formula
C12H24O2
SMILES
CCC(C)CCCOC(=O)CC(C)C
Molecular Weight1
200.32
CAS
1215127-80-2
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Physical Properties

Property Value Unit Source
Δf -188.64 kJ/mol Joback Calculated Property
Δfgas -546.37 kJ/mol Joback Calculated Property
Δfus 22.58 kJ/mol Joback Calculated Property
Δvap 50.69 kJ/mol Joback Calculated Property
log10WS -3.22 Crippen Calculated Property
logPoct/wat 3.402 Crippen Calculated Property
McVol 187.380 ml/mol McGowan Calculated Property
Pc 1877.28 kPa Joback Calculated Property
Inp 1311.60 NIST
Tboil 549.37 K Joback Calculated Property
Tc 725.46 K Joback Calculated Property
Tfus 267.16 K Joback Calculated Property
Vc 0.720 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [464.71; 553.06] J/mol×K [549.37; 725.46] Show Hide
Cp,gas 464.71 J/mol×K 549.37 Joback Calculated Property
Cp,gas 481.08 J/mol×K 578.72 Joback Calculated Property
Cp,gas 496.78 J/mol×K 608.07 Joback Calculated Property
Cp,gas 511.82 J/mol×K 637.42 Joback Calculated Property
Cp,gas 526.20 J/mol×K 666.76 Joback Calculated Property
Cp,gas 539.94 J/mol×K 696.11 Joback Calculated Property
Cp,gas 553.06 J/mol×K 725.46 Joback Calculated Property
η [0.0001657; 0.0062070] Pa×s [267.16; 549.37] Show Hide
η 0.0062070 Pa×s 267.16 Joback Calculated Property
η 0.0021594 Pa×s 314.19 Joback Calculated Property
η 0.0009890 Pa×s 361.23 Joback Calculated Property
η 0.0005423 Pa×s 408.26 Joback Calculated Property
η 0.0003366 Pa×s 455.30 Joback Calculated Property
η 0.0002285 Pa×s 502.33 Joback Calculated Property
η 0.0001657 Pa×s 549.37 Joback Calculated Property

Similar Compounds

5-Methylhexyl 3-methylbutanoate. 6-Methylheptyl 3-methylbutanoate. 4-Methylpentyl 3-methylbutanoate. Butyl 3-methylhexanoate. Butanoic acid, 3-methyl-, hexyl ester. Hexyl isovalerate. Eicosyl 3-methylpentanoate. Heptyl isopentanoate. Isovaleric acid, pentadecyl ester. Isovaleric acid, heptadecyl ester. Isovaleric acid, tetracosyl ester. Isovaleric acid, dodecyl ester. Isovaleric acid, tetradecyl ester. Butanoic acid, 3-methyl-, octyl ester. Docosyl, isovalerate.

Find more compounds similar to 4-Methylhexyl 3-methylbutanoate.

Sources

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