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
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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
log10WS -4.67 Crippen Calculated Property
logPoct/wat 4.412 Crippen Calculated Property
McVol 221.050 ml/mol McGowan Calculated Property
Pc 1602.56 kPa Joback Calculated Property
Inp [1584.00; 1677.00]   Show Hide
Inp 1659.00 NIST
Inp 1630.00 NIST
Inp 1629.00 NIST
Inp 1633.00 NIST
Inp 1629.00 NIST
Inp 1624.00 NIST
Inp 1630.00 NIST
Inp 1641.00 NIST
Inp Outlier 1677.00 NIST
Inp 1658.90 NIST
Inp Outlier 1584.00 NIST
Inp 1649.00 NIST
Inp 1642.00 NIST
Inp 1636.00 NIST
Inp 1640.00 NIST
Inp 1625.00 NIST
Inp 1642.00 NIST
Inp 1632.00 NIST
Inp 1659.00 NIST
Inp 1624.00 NIST
Inp 1658.90 NIST
I [1953.00; 1994.00]   Show Hide
I 1983.00 NIST
I 1994.00 NIST
I 1953.00 NIST
I 1964.00 NIST
I 1960.00 NIST
I 1994.00 NIST
I 1983.00 NIST
Tboil 626.97 K Joback Calculated Property
Tc 810.82 K Joback Calculated Property
Tfus 292.89 K Joback Calculated Property
Vc 0.862 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [579.64; 670.10] J/mol×K [626.97; 810.82] Show Hide
Cp,gas 579.64 J/mol×K 626.97 Joback Calculated Property
Cp,gas 596.65 J/mol×K 657.61 Joback Calculated Property
Cp,gas 612.84 J/mol×K 688.25 Joback Calculated Property
Cp,gas 628.25 J/mol×K 718.90 Joback Calculated Property
Cp,gas 642.90 J/mol×K 749.54 Joback Calculated Property
Cp,gas 656.84 J/mol×K 780.18 Joback Calculated Property
Cp,gas 670.10 J/mol×K 810.82 Joback Calculated Property

Similar Compounds

Neryl valerate. (2E,6E)-Farnesyl pentanoate. Farnesyl hexanoate, (E,E)-. Neryl hexanoate. Hexanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-. (E,Z)-Farnesyl caproate. (Z,E)-Farnesyl caproate. (Z,Z)-Farnesyl caproate. (E,Z)-Farnesyl caprate. (2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl decanoate. (2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl stearate. (Z,Z)-Farnesyl caprate. Neryl heptanoate. Farnesyl octanoate, (E,E)-. (E)-3,7-Dimethylocta-2,6-dien-1-yl icosanoate.

Find more compounds similar to Pentanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.