Chemical Properties of Pentanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)- (CAS 10402-47-8)

Pentanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-

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InChI
InChI=1S/C15H26O2/c1-5-6-10-15(16)17-12-11-14(4)9-7-8-13(2)3/h8,11H,5-7,9-10,12H2,1-4H3/b14-11+
InChI Key
CVSWGLSBJFKWMW-SDNWHVSQSA-N
Formula
C15H26O2
SMILES
CCCCC(=O)OCC=C(C)CCC=C(C)C
Molecular Weight1
238.37
CAS
10402-47-8
Other Names
  • (2E)-3,7-Dimethyl-2,6-octadienyl pentanoate
  • Geranyl pentanoate
  • Geranyl valerate
Sources

Physical Properties

Property Value Unit Source
Δf -15.16 kJ/mol Joback Calculated Property
Δfgas -382.87 kJ/mol Joback Calculated Property
Δfus 35.18 kJ/mol Joback Calculated Property
Δvap 58.22 kJ/mol Joback Calculated Property
logPoct/wat 4.41 Crippen Calculated Property
Pc 1602.56 kPa Joback Calculated Property
Tboil 626.97 K Joback Calculated Property
Tc 810.82 K Joback Calculated Property
Tfus 292.89 K Joback Calculated Property
Vc 0.86 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 579.64 J/mol×K 626.97 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< 2
>C=O (nonring) 1
-CH2- 6
=CH- 2
-CH3 4

Similar Compounds

Neryl valerate. (2E,6E)-Farnesyl pentanoate. Neryl hexanoate. Hexanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-. Geranyl isohexanoate. (Z,Z)-Farnesyl caproate. (E,Z)-Farnesyl caproate. (Z,E)-Farnesyl caproate. Farnesyl hexanoate, (E,E)-. Neryl butyrate. Butanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-. Geranyl heptanoate. Neryl heptanoate. (E)-3,7-Dimethylocta-2,6-dien-1-yl dodecanoate. (E)-3,7-Dimethylocta-2,6-dien-1-yl tetradecanoate.

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