Chemical Properties of 1,6-Octadiene, 3,7-dimethyl- (CAS 2436-90-0)

1,6-Octadiene, 3,7-dimethyl-

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InChI
InChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h5,7,10H,1,6,8H2,2-4H3
InChI Key
FUDNBFMOXDUIIE-UHFFFAOYSA-N
Formula
C10H18
SMILES
C=CC(C)CCC=C(C)C
Molecular Weight1
138.25
CAS
2436-90-0
Other Names
  • (-)-(1S)-cis-pinane
  • (-)-(1S,2R,5S)-cis-pinane
  • (-)-cis-pinane
  • .beta.-citronellene
  • 2,6-Dimethyl 2,7-octadiene
  • 3,7-Dimethyl-1,6-octadiene
  • 3,7-Dimethyl-octa-1,6-diene
  • Citronellene
  • Dihydromyrcene
  • [1S-(1.alpha.,2.beta.,5.alpha.)]-2,6,6-trimethylbicyclo[3.1.1]heptane
  • bicyclo[3.1.1]heptane, 2,6,6-trimethyl-,
  • pinane, (1S,2R,5S)-(-)-
  • pinane, cis-(-)-
  • «beta»-Citronellene
  • «beta»-Citronellene
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Physical Properties

Property Value Unit Source
Δf 190.39 kJ/mol Joback Calculated Property
Δfgas -22.15 kJ/mol Joback Calculated Property
Δfus 15.74 kJ/mol Joback Calculated Property
Δvap 36.83 kJ/mol Joback Calculated Property
log10WS -3.47 Crippen Calculated Property
logPoct/wat 3.555 Crippen Calculated Property
McVol 143.160 ml/mol McGowan Calculated Property
Pc 2331.52 kPa Joback Calculated Property
Inp [939.00; 982.00]   Show Hide
Inp 947.00 NIST
Inp 945.00 NIST
Inp 944.00 NIST
Inp 939.00 NIST
Inp 946.00 NIST
Inp Outlier 982.00 NIST
Inp 946.00 NIST
I [1049.00; 1088.00]   Show Hide
I 1049.00 NIST
I 1088.00 NIST
Tboil 432.00 ± 3.00 K NIST
Tc 609.41 K Joback Calculated Property
Tfus 166.66 K Joback Calculated Property
Vc 0.551 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [284.02; 364.58] J/mol×K [428.48; 609.41] Show Hide
Cp,gas 284.02 J/mol×K 428.48 Joback Calculated Property
Cp,gas 299.14 J/mol×K 458.64 Joback Calculated Property
Cp,gas 313.54 J/mol×K 488.79 Joback Calculated Property
Cp,gas 327.26 J/mol×K 518.95 Joback Calculated Property
Cp,gas 340.32 J/mol×K 549.10 Joback Calculated Property
Cp,gas 352.75 J/mol×K 579.26 Joback Calculated Property
Cp,gas 364.58 J/mol×K 609.41 Joback Calculated Property
n0 1.44160 293.10 Liquid ...

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.67] kPa [325.18; 457.66] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.53459e+01
Coefficient B-3.98444e+03
Coefficient C-6.05790e+01
Temperature range, min.325.18
Temperature range, max.457.66
Pvap 1.33 kPa 325.18 Calculated Property
Pvap 2.95 kPa 339.90 Calculated Property
Pvap 6.02 kPa 354.62 Calculated Property
Pvap 11.49 kPa 369.34 Calculated Property
Pvap 20.67 kPa 384.06 Calculated Property
Pvap 35.33 kPa 398.78 Calculated Property
Pvap 57.74 kPa 413.50 Calculated Property
Pvap 90.74 kPa 428.22 Calculated Property
Pvap 137.73 kPa 442.94 Calculated Property
Pvap 202.67 kPa 457.66 Calculated Property

Similar Compounds

R(-)3,7-Dimethyl-1,6-octadiene. 1,6-Octadiene, 5,7-dimethyl-, (R)-. 2,4-Dimethyl 2,7-octadiene. (Z,Z)-1,6-Cyclodecadiene, 3-methyl. 2-Heptene, 2,6-dimethyl-. 3,7-Dimethyl-3-octene. (E,E)-1,6-Cyclodecadiene, 3-methyl. 4-Methyl-2-heptene. (Z)-2-Heptene, 4-methyl. 2-Heptene, 4-methyl-, (E)-. 2-Octene, 2,7-dimethyl-. 2-Decene, 2,4-dimethyl-. Cyclohexene, 3-methyl-. 2-Octene, 2,6-dimethyl-. 2,6,10,14-Tetramethyl-7-(3-methyl-pent-4-enyl)-pentadec-5-ene.

Find more compounds similar to 1,6-Octadiene, 3,7-dimethyl-.

Mixtures

Sources

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