Chemical Properties of Butanoic acid, 5-hexenyl ester (CAS 108058-75-9)

Butanoic acid, 5-hexenyl ester

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InChI
InChI=1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h3H,1,4-9H2,2H3
InChI Key
YLSXHHJLLXESHB-UHFFFAOYSA-N
Formula
C10H18O2
SMILES
C=CCCCCOC(=O)CCC
Molecular Weight1
170.25
CAS
108058-75-9
Other Names
  • 5-Hexenyl butyrate
Sources

Physical Properties

Property Value Unit Source
Δf -112.76 kJ/mol Joback Calculated Property
Δfgas -369.10 kJ/mol Joback Calculated Property
Δfus 23.16 kJ/mol Joback Calculated Property
Δvap 46.34 kJ/mol Joback Calculated Property
logPoct/wat 2.69 Crippen Calculated Property
Pc 2289.32 kPa Joback Calculated Property
Tboil 501.17 K Joback Calculated Property
Tc 676.68 K Joback Calculated Property
Tfus 272.86 K Joback Calculated Property
Vc 0.60 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 349.85 J/mol×K 501.17 Joback Calculated Property
η 0.00 Pa×s 501.17 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 1
=CH2 1
-CH2- 6
=CH- 1
>C=O (nonring) 1

Similar Compounds

5-hexenyl 5-hexenoate. Amyl butanoate. hexyl 5-hexenoate. Hexanoic acid, 5-hexenyl ester. 9-Decenyl butyrate. Butanoic acid, hexyl ester. 5-Hexene-1-ol, acetate. Pentanoic acid, pentyl ester. Hex-5-enoic acid, ethyl ester. 5-hexenyl octanoate. Succinic acid, di(hex-5-en-1-yl) ester. Amyl propionate. Butanoic acid, heptyl ester. n-Butyl pentenoate. Pentanoic acid, 9-decenyl ester.

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