Chemical Properties of 1,3,6-Octatriene, 3,7-dimethyl-, (Z)- (CAS 3338-55-4)

1,3,6-Octatriene, 3,7-dimethyl-, (Z)-

InChI
InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7-8H,1,6H2,2-4H3/b10-8-
InChI Key
IHPKGUQCSIINRJ-NTMALXAHSA-N
Formula
C10H16
SMILES
C=C/C(C)=C\CC=C(C)C
Molecular Weight1
136.24
CAS
3338-55-4
Other Names
  • «beta»-cis-Ocimene
  • cis-«beta»-Ocimene
  • cis-3,7-Dimethyl-1,3,6-octatriene
  • Ocimene, cis-«beta»-
  • (Z)-Ocimene
  • cis-Ocimene
  • (3Z)-3,7-Dimethyl-1,3,6-octatriene
  • «beta»-Ocimene, (Z)-
  • «beta»-(Z)-Ocimene
  • (Z)-«beta»-Ocimene
  • (Z)-3,7-Dimethyl-1,3,6-octatriene
  • 1,3,6-Octatriene, 3,7-dimethyl-, (3Z)-
  • (Z)-3,7-Dimethylocta-1,3,6-triene
  • ocimene-y
  • «beta»-Ocymene, (Z)-
  • (Z)- «beta»-Ocimene (cis-ocimene)
  • p-cis-Ocimene
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Physical Properties

Property Value Unit Source
ΔfusH° 18.16 kJ/mol Joback Calculated Property
ΔvapH° 50.21 kJ/mol Relay (1.0) Calculated Property
IE 8.14 eV Relay (1.0) Calculated Property
logPoct/wat 3.475 Crippen Calculated Property
McVol 138.860 ml/mol McGowan Calculated Property
Inp [1002.00; 1084.00]   Show Hide
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Tboil 440.82 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [180.11; 445.02] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-3.69390e+01
Coefficient B9.73660e-01
Coefficient C-7.15300e-04
Coefficient D2.23600e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 180.11 J/mol×K 273.00 Calculated Property
Cp,gas 227.89 J/mol×K 353.78 Calculated Property
Cp,gas 269.44 J/mol×K 434.56 Calculated Property
Cp,gas 305.46 J/mol×K 515.33 Calculated Property
Cp,gas 336.65 J/mol×K 596.11 Calculated Property
Cp,gas 363.73 J/mol×K 676.89 Calculated Property
Cp,gas 387.40 J/mol×K 757.67 Calculated Property
Cp,gas 408.37 J/mol×K 838.44 Calculated Property
Cp,gas 427.34 J/mol×K 919.22 Calculated Property
Cp,gas 445.02 J/mol×K 1000.00 Calculated Property

Similar Compounds

«beta»-Ocimene. trans-«beta»-Ocimene. 1,3,5-Cycloheptatriene, methyl. 2,4-Heptadiene, 2,4-dimethyl-. ( Z, Z)-farnesene. 2-Methyl-1,3-cyclopentadiene. 1,4-Hexadiene, 5-methyl-. (Z)-2,6-Dimethylocta-2,5,7-trien-4-one. (E)-2,6-Dimethylocta-2,5,7-trien-4-one. Ocimenone. 1,3-Pentadiene, 3-methyl-. 1,3-Pentadiene, 3-methyl-, (Z)-. 2,6-Dimethyl-2,5-heptadiene. (Z)-«beta»-Ocimenol. trans-Ocimenol.

Find more compounds similar to 1,3,6-Octatriene, 3,7-dimethyl-, (Z)-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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