Chemical Properties of Butanoic acid, 2-methyloct-5-yn-4-yl ester

Butanoic acid, 2-methyloct-5-yn-4-yl ester

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InChI
InChI=1S/C13H22O2/c1-5-7-9-12(10-11(3)4)15-13(14)8-6-2/h11-12H,5-6,8,10H2,1-4H3
InChI Key
PGGRYTIUNQVTQV-UHFFFAOYSA-N
Formula
C13H22O2
SMILES
CCC#CC(CC(C)C)OC(=O)CCC
Molecular Weight1
210.31
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Physical Properties

Property Value Unit Source
Δf 22.58 kJ/mol Joback Calculated Property
Δfgas -294.71 kJ/mol Joback Calculated Property
Δfus 28.29 kJ/mol Joback Calculated Property
Δvap 55.06 kJ/mol Joback Calculated Property
log10WS -3.79 Crippen Calculated Property
logPoct/wat 3.158 Crippen Calculated Property
McVol 192.870 ml/mol McGowan Calculated Property
Pc 1985.89 kPa Joback Calculated Property
Inp 1348.00 NIST
Tboil 581.25 K Joback Calculated Property
Tc 775.23 K Joback Calculated Property
Tfus 384.53 K Joback Calculated Property
Vc 0.738 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [478.22; 566.48] J/mol×K [581.25; 775.23] Show Hide
Cp,gas 478.22 J/mol×K 581.25 Joback Calculated Property
Cp,gas 494.78 J/mol×K 613.58 Joback Calculated Property
Cp,gas 510.59 J/mol×K 645.91 Joback Calculated Property
Cp,gas 525.65 J/mol×K 678.24 Joback Calculated Property
Cp,gas 539.97 J/mol×K 710.57 Joback Calculated Property
Cp,gas 553.58 J/mol×K 742.90 Joback Calculated Property
Cp,gas 566.48 J/mol×K 775.23 Joback Calculated Property

Similar Compounds

Valeric acid, 2-methyloct-5-yn-4-yl ester. Glutaric acid, di(2-methyloct-5-yn-4-yl) ester. Succinic acid, di(2-methyloct-5-yn-4-yl) ester. Hexanoic acid, 2-methyloct-5-yn-4-yl ester. Succinic acid, hex-4-yn-3-yl 2-methyloct-5-yn-4-yl ester. Octanoic acid, 2-methyloct-5-yn-4-yl ester. 4-Bromobutanoic acid, 2-methyl-5-yn-4-yl ester. Glutaric acid, 2-methyloct-5-yn-4-yl propyl ester. Undec-10-ynoic acid, 2-methyloct-5-yn-4-yl ester. Glutaric acid, butyl 2-methyloct-5-yn-4-yl ester. 5-Bromovaleric acid, 2-methyloct-5-yn-4-yl ester. Glutaric acid, 2-methyloct-5-yn-4-yl pentyl ester. 5-Chlorovaleric acid, 2-methyloct-5-yn-4-yl ester. Cyclopropanecarboxylic acid, 2-methyloct-5-yn-4-yl ester. Glutaric acid, isobutyl 2-methyloct-5-yn-4-yl ester.

Find more compounds similar to Butanoic acid, 2-methyloct-5-yn-4-yl ester.

Sources

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