Chemical Properties of Cyclohexene, 3-(1,5-dimethyl-4-hexenyl)-6-methylene-, [S-(R*,S*)]- (CAS 20307-83-9)

Cyclohexene, 3-(1,5-dimethyl-4-hexenyl)-6-methylene-, [S-(R*,S*)]-

InChI
InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,10,14-15H,3,5,7,9,11H2,1-2,4H3/t14?,15-/m1/s1
InChI Key
PHWISBHSBNDZDX-YSSOQSIOSA-N
Formula
C15H24
SMILES
C=C1C=CC(C(C)CCC=C(C)C)CC1
Molecular Weight1
204.35
CAS
20307-83-9
Other Names
  • «beta»-Sesquiphellandrene
  • 3-((1S)-1,5-Dimethyl-4-hexenyl)-6-methylene-1-cyclohexene, (3R)-
  • (-)-«beta»-Sesquiphellandrene
  • «beta»-Sesquiphellanderene
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Physical Properties

Property Value Unit Source
ΔfusH° 21.87 kJ/mol Joback Calculated Property
logPoct/wat 4.891 Crippen Calculated Property
McVol 198.450 ml/mol McGowan Calculated Property
Inp [1493.00; 1561.00]   Show Hide
Inp 1509.00 NIST
Inp 1517.00 NIST
Inp 1525.00 NIST
Inp 1520.00 NIST
Inp 1512.00 NIST
Inp 1523.00 NIST
Inp Outlier 1540.00 NIST
Inp 1524.00 NIST
Inp 1522.00 NIST
Inp 1516.00 NIST
Inp 1512.00 NIST
Inp 1524.00 NIST
Inp 1522.00 NIST
Inp 1523.00 NIST
Inp 1509.00 NIST
Inp 1522.00 NIST
Inp 1519.00 NIST
Inp 1510.00 NIST
Inp 1520.00 NIST
Inp 1525.00 NIST
Inp 1516.00 NIST
Inp 1524.00 NIST
Inp 1525.00 NIST
Inp 1526.00 NIST
Inp 1516.00 NIST
Inp 1531.00 NIST
Inp 1521.00 NIST
Inp 1517.00 NIST
Inp 1526.00 NIST
Inp 1511.00 NIST
Inp 1510.00 NIST
Inp 1519.00 NIST
Inp 1514.00 NIST
Inp 1524.00 NIST
Inp 1526.00 NIST
Inp 1524.00 NIST
Inp 1524.00 NIST
Inp 1525.00 NIST
Inp 1524.00 NIST
Inp 1526.00 NIST
Inp 1518.00 NIST
Inp 1503.00 NIST
Inp 1523.00 NIST
Inp 1525.00 NIST
Inp 1526.00 NIST
Inp 1518.00 NIST
Inp 1527.00 NIST
Inp 1525.00 NIST
Inp 1520.00 NIST
Inp 1516.00 NIST
Inp 1526.00 NIST
Inp 1524.00 NIST
Inp 1525.00 NIST
Inp 1528.00 NIST
Inp 1518.00 NIST
Inp 1528.00 NIST
Inp 1517.00 NIST
Inp 1515.00 NIST
Inp 1514.00 NIST
Inp Outlier 1501.00 NIST
Inp 1518.00 NIST
Inp 1518.34 NIST
Inp 1518.00 NIST
Inp Outlier 1543.00 NIST
Inp 1507.00 NIST
Inp 1512.00 NIST
Inp 1526.40 NIST
Inp 1536.00 NIST
Inp 1523.00 NIST
Inp 1525.00 NIST
Inp 1524.00 NIST
Inp 1524.00 NIST
Inp Outlier 1540.00 NIST
Inp 1518.00 NIST
Inp Outlier 1561.00 NIST
Inp 1530.00 NIST
Inp 1518.00 NIST
Inp 1518.00 NIST
Inp 1524.00 NIST
Inp 1534.00 NIST
Inp 1523.00 NIST
Inp 1518.00 NIST
Inp 1527.00 NIST
Inp 1516.00 NIST
Inp 1526.00 NIST
Inp 1507.00 NIST
Inp 1523.00 NIST
Inp 1517.00 NIST
Inp 1523.00 NIST
Inp 1519.00 NIST
Inp 1526.00 NIST
Inp 1529.00 NIST
Inp 1523.00 NIST
Inp 1526.00 NIST
Inp Outlier 1493.00 NIST
Inp 1512.00 NIST
Inp 1504.00 NIST
Inp Outlier 1543.00 NIST
Inp Outlier 1557.00 NIST
Inp 1507.00 NIST
Inp 1522.00 NIST
Inp 1516.00 NIST
Inp 1520.00 NIST
Inp 1523.00 NIST
Inp 1512.00 NIST
Inp 1523.00 NIST
Inp 1523.00 NIST
Inp 1523.00 NIST
Inp Outlier 1501.00 NIST
Inp 1521.00 NIST
Inp 1525.00 NIST
Inp 1524.00 NIST
Inp 1522.00 NIST
Inp 1512.00 NIST
Inp 1524.00 NIST
Inp 1529.00 NIST
Inp 1520.00 NIST
Inp 1524.00 NIST
Inp 1528.00 NIST
Inp 1524.00 NIST
Inp Outlier 1501.00 NIST
Inp 1525.00 NIST
Inp 1526.00 NIST
Inp 1526.00 NIST
Inp 1528.00 NIST
Inp 1503.00 NIST
Inp Outlier 1500.00 NIST
Inp 1527.00 NIST
Inp 1525.00 NIST
Inp 1525.00 NIST
Inp 1518.00 NIST
Inp 1528.00 NIST
Inp 1518.00 NIST
Inp Outlier 1500.00 NIST
Inp 1517.40 NIST
Inp 1514.00 NIST
Inp 1521.00 NIST
Inp 1504.00 NIST
Inp 1512.00 NIST
Inp 1512.00 NIST
Inp 1526.00 NIST
Inp 1534.00 NIST
Inp 1530.00 NIST
Inp 1516.00 NIST
Inp 1528.00 NIST
Inp 1530.00 NIST
Inp 1524.00 NIST
Inp 1514.00 NIST
Inp 1520.00 NIST
Inp 1522.00 NIST
Inp 1522.00 NIST
Inp 1522.00 NIST
Inp 1508.00 NIST
Inp 1508.00 NIST
Inp 1520.00 NIST
Inp 1534.00 NIST
Inp 1528.00 NIST
Inp 1530.00 NIST
Inp 1516.00 NIST
Inp 1508.00 NIST
Inp 1526.00 NIST
Inp 1523.00 NIST
Inp 1512.00 NIST
Inp 1523.00 NIST
Inp 1507.00 NIST
Inp 1526.00 NIST
Inp 1526.00 NIST
Inp 1526.00 NIST
Inp 1526.00 NIST
Inp 1523.00 NIST
Inp Outlier 1498.00 NIST
Inp 1508.00 NIST
Inp 1523.00 NIST
Inp 1526.00 NIST
Inp 1523.00 NIST
Inp 1535.00 NIST
Inp 1535.00 NIST
Inp 1510.00 NIST
Inp 1511.00 NIST
Inp 1508.00 NIST
Inp 1515.00 NIST
Inp 1508.00 NIST
Inp 1511.00 NIST
Inp 1527.00 NIST
Inp 1528.00 NIST
Inp 1516.00 NIST
Inp 1531.00 NIST
Inp 1510.00 NIST
Inp 1524.00 NIST
Inp 1518.00 NIST
Inp 1526.00 NIST
Inp 1528.00 NIST
Inp 1512.00 NIST
Inp 1525.00 NIST
Inp 1522.00 NIST
Inp 1526.40 NIST
Ip [1727.00; 1794.00]   Show Hide
Ip 1746.00 NIST
Ip 1775.00 NIST
Ip 1764.00 NIST
Ip 1768.00 NIST
Ip Outlier 1727.00 NIST
Ip 1765.00 NIST
Ip 1761.00 NIST
Ip 1766.00 NIST
Ip 1783.00 NIST
Ip 1768.00 NIST
Ip 1763.00 NIST
Ip 1767.00 NIST
Ip 1780.00 NIST
Ip 1776.00 NIST
Ip 1773.00 NIST
Ip 1768.00 NIST
Ip 1767.00 NIST
Ip 1758.00 NIST
Ip 1780.00 NIST
Ip 1772.00 NIST
Ip 1778.00 NIST
Ip 1777.00 NIST
Ip 1762.00 NIST
Ip 1768.00 NIST
Ip 1771.00 NIST
Ip 1766.00 NIST
Ip 1789.00 NIST
Ip 1782.00 NIST
Ip 1748.00 NIST
Ip Outlier 1743.00 NIST
Ip Outlier 1743.00 NIST
Ip 1771.00 NIST
Ip 1771.00 NIST
Ip 1767.00 NIST
Ip 1761.00 NIST
Ip 1764.00 NIST
Ip 1771.00 NIST
Ip 1754.00 NIST
Ip 1752.00 NIST
Ip 1776.00 NIST
Ip 1776.00 NIST
Ip 1764.00 NIST
Ip Outlier 1729.00 NIST
Ip 1771.00 NIST
Ip 1787.00 NIST
Ip 1783.00 NIST
Ip 1750.00 NIST
Ip 1772.00 NIST
Ip 1776.00 NIST
Ip 1760.00 NIST
Ip 1782.00 NIST
Ip 1783.00 NIST
Ip 1783.00 NIST
Ip 1794.00 NIST
Ip 1770.00 NIST
Ip 1776.00 NIST
Ip 1773.00 NIST
Ip 1755.00 NIST
Ip 1778.00 NIST
Ip 1776.00 NIST
Ip 1776.00 NIST
Ip 1783.00 NIST
Ip 1783.00 NIST
Ip 1783.00 NIST
Ip 1783.00 NIST
Ip 1781.00 NIST
Ip 1783.00 NIST
Ip 1783.00 NIST
Ip 1776.00 NIST
Ip 1783.00 NIST
Ip 1783.00 NIST
Ip 1783.00 NIST
Ip 1783.00 NIST
Ip 1754.00 NIST
Ip 1768.00 NIST
Ip 1765.00 NIST
Ip 1763.00 NIST
Ip 1768.00 NIST
Ip 1778.00 NIST
Ip 1766.00 NIST
Ip Outlier 1743.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [261.44; 684.74] 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-6.18380e+01
Coefficient B1.40326e+00
Coefficient C-8.57380e-04
Coefficient D2.00700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 261.44 J/mol×K 273.00 Calculated Property
Cp,gas 336.18 J/mol×K 353.78 Calculated Property
Cp,gas 402.52 J/mol×K 434.56 Calculated Property
Cp,gas 461.08 J/mol×K 515.33 Calculated Property
Cp,gas 512.51 J/mol×K 596.11 Calculated Property
Cp,gas 557.42 J/mol×K 676.89 Calculated Property
Cp,gas 596.47 J/mol×K 757.67 Calculated Property
Cp,gas 630.28 J/mol×K 838.44 Calculated Property
Cp,gas 659.50 J/mol×K 919.22 Calculated Property
Cp,gas 684.74 J/mol×K 1000.00 Calculated Property

Similar Compounds

(6S)-2-Methyl-6-[(1R)-4-methylenecyclohex-2-enyl]hept-2-ene. (-)-Germacrene D. Germacrene D. Isogermacrene D. Germacrene D isomer # 1. Isocembrene. «beta»-Phellandrene. «delta»-phellandrene. Isogermacrene D. «beta»-Cuprenene. «delta»-Cuprenene. (R)-3-Methylene-6-((S)-1,2,2-trimethylcyclopentyl)cyclohex-1-ene. Curlone. Cembrene C. 3(Z)-Cembrene A.

Find more compounds similar to Cyclohexene, 3-(1,5-dimethyl-4-hexenyl)-6-methylene-, [S-(R*,S*)]-.

Sources

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