Chemical Properties of 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl- (CAS 7212-44-4)

1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-

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InChI
InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3
InChI Key
FQTLCLSUCSAZDY-UHFFFAOYSA-N
Formula
C15H26O
SMILES
C=CC(C)(O)CCC=C(C)CCC=C(C)C
Molecular Weight1
222.37
CAS
7212-44-4
Other Names
  • Nerolidol
  • 3,7,11-Trimethyl-1,6,10-dodecatrien-3-ol
  • 3,7,11-Trimethyldodeca-1,6,10-trien-3-ol
  • 3-Hydroxy-3,7,11-trimethyl-1,6,10-dodecatriene
  • (.+/-.)-Nerolidol
  • 3,7,11-Trimethyl-1,6,10-dodecatriene-3-ol
  • FCI 119b
  • 3,7,11-trimethyl-1,6,10-dodecatrien-3-ol (nerolidol)
  • 3,7,11-trimethyldodeca-1,6,10-trien-3-ol,mixed isomers
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Physical Properties

Property Value Unit Source
Δf 172.62 kJ/mol Joback Calculated Property
Δfgas -173.62 kJ/mol Joback Calculated Property
Δfus 27.78 kJ/mol Joback Calculated Property
Δvap 63.77 kJ/mol Joback Calculated Property
log10WS -5.04 Crippen Calculated Property
logPoct/wat 4.396 Crippen Calculated Property
McVol 215.180 ml/mol McGowan Calculated Property
Pc 1749.21 kPa Joback Calculated Property
Inp [1514.00; 1608.00]   Show Hide
Inp 1562.00 NIST
Inp 1566.00 NIST
Inp 1562.00 NIST
Inp 1570.00 NIST
Inp 1563.00 NIST
Inp 1539.00 NIST
Inp 1539.00 NIST
Inp 1565.00 NIST
Inp 1555.00 NIST
Inp 1555.00 NIST
Inp 1550.00 NIST
Inp 1552.00 NIST
Inp 1551.00 NIST
Inp 1552.00 NIST
Inp 1551.00 NIST
Inp 1550.00 NIST
Inp 1553.00 NIST
Inp 1565.00 NIST
Inp 1564.00 NIST
Inp 1583.00 NIST
Inp 1583.00 NIST
Inp 1571.00 NIST
Inp 1565.60 NIST
Inp 1568.00 NIST
Inp 1545.00 NIST
Inp 1572.50 NIST
Inp 1567.70 NIST
Inp 1568.90 NIST
Inp 1562.00 NIST
Inp 1568.00 NIST
Inp 1574.00 NIST
Inp 1565.00 NIST
Inp 1573.00 NIST
Inp 1562.00 NIST
Inp 1547.00 NIST
Inp 1538.00 NIST
Inp 1564.00 NIST
Inp 1562.00 NIST
Inp 1565.00 NIST
Inp 1564.00 NIST
Inp 1552.00 NIST
Inp 1561.00 NIST
Inp 1564.00 NIST
Inp 1560.00 NIST
Inp 1554.00 NIST
Inp 1533.00 NIST
Inp 1561.00 NIST
Inp 1575.00 NIST
Inp 1541.00 NIST
Inp 1566.00 NIST
Inp 1562.00 NIST
Inp 1548.00 NIST
Inp 1551.00 NIST
Inp 1545.00 NIST
Inp 1546.00 NIST
Inp 1544.00 NIST
Inp 1559.00 NIST
Inp 1539.00 NIST
Inp 1563.00 NIST
Inp 1550.00 NIST
Inp 1569.00 NIST
Inp Outlier 1520.00 NIST
Inp 1570.00 NIST
Inp Outlier 1608.00 NIST
Inp 1574.00 NIST
Inp 1544.00 NIST
Inp 1566.00 NIST
Inp 1578.00 NIST
Inp 1556.00 NIST
Inp 1545.00 NIST
Inp 1548.00 NIST
Inp 1544.00 NIST
Inp 1560.00 NIST
Inp 1567.00 NIST
Inp 1570.00 NIST
Inp 1548.00 NIST
Inp 1582.00 NIST
Inp 1559.00 NIST
Inp 1567.00 NIST
Inp 1558.00 NIST
Inp 1566.00 NIST
Inp 1564.00 NIST
Inp 1569.00 NIST
Inp 1561.00 NIST
Inp 1540.00 NIST
Inp 1564.00 NIST
Inp 1561.00 NIST
Inp 1553.00 NIST
Inp 1555.00 NIST
Inp Outlier 1527.00 NIST
Inp 1564.00 NIST
Inp 1533.00 NIST
Inp 1553.00 NIST
Inp 1563.00 NIST
Inp 1559.00 NIST
Inp 1555.00 NIST
Inp 1548.00 NIST
Inp 1548.00 NIST
Inp 1548.00 NIST
Inp 1543.00 NIST
Inp 1553.00 NIST
Inp 1554.00 NIST
Inp 1550.00 NIST
Inp 1552.00 NIST
Inp 1554.00 NIST
Inp 1578.00 NIST
Inp 1548.00 NIST
Inp 1551.00 NIST
Inp Outlier 1525.00 NIST
Inp 1550.00 NIST
Inp 1551.00 NIST
Inp 1551.00 NIST
Inp 1551.00 NIST
Inp 1551.00 NIST
Inp 1556.00 NIST
Inp 1568.00 NIST
Inp Outlier 1514.00 NIST
Inp 1558.00 NIST
Inp 1541.00 NIST
Inp Outlier 1530.00 NIST
Inp 1560.00 NIST
Inp 1561.00 NIST
Inp 1564.00 NIST
Inp 1564.00 NIST
Inp 1565.00 NIST
Inp 1565.00 NIST
Inp 1545.00 NIST
Inp 1562.00 NIST
Inp 1553.00 NIST
Inp 1564.00 NIST
Inp 1539.00 NIST
Inp 1551.00 NIST
Inp 1553.00 NIST
Inp 1547.00 NIST
Inp Outlier 1520.00 NIST
Inp 1570.00 NIST
Inp 1578.00 NIST
Inp 1560.00 NIST
Inp 1559.00 NIST
Inp 1569.00 NIST
Inp 1553.00 NIST
Inp 1548.00 NIST
Inp 1550.00 NIST
Inp 1551.00 NIST
I [1990.00; 2065.00]   Show Hide
I 1991.00 NIST
I 2030.00 NIST
I 2053.00 NIST
I 2053.00 NIST
I 2009.00 NIST
I 2000.00 NIST
I 2000.00 NIST
I 2021.00 NIST
I 2020.00 NIST
I 2050.00 NIST
I 2046.00 NIST
I 2050.00 NIST
I 2039.00 NIST
I 2037.00 NIST
I 2024.00 NIST
I 2033.00 NIST
I 2031.00 NIST
I 2057.00 NIST
I 1991.00 NIST
I 1991.00 NIST
I 2003.00 NIST
I 2003.00 NIST
I 2056.00 NIST
I 2041.00 NIST
I 2044.00 NIST
I 2034.00 NIST
I 2035.00 NIST
I 2008.00 NIST
I 2050.00 NIST
I 2050.00 NIST
I 2030.00 NIST
I 2052.00 NIST
I 2012.00 NIST
I 2045.00 NIST
I 1999.00 NIST
I 2034.00 NIST
I 2049.00 NIST
I 2048.00 NIST
I 2037.00 NIST
I 2039.00 NIST
I 2003.00 NIST
I 2003.00 NIST
I 2047.00 NIST
I 2043.00 NIST
I 2025.00 NIST
I 2002.00 NIST
I 1990.00 NIST
I 2047.00 NIST
I 2031.00 NIST
I 2041.00 NIST
I 2044.00 NIST
I 2043.00 NIST
I 1991.00 NIST
I 2003.00 NIST
I 2005.00 NIST
I 1991.00 NIST
I 2005.00 NIST
I 2056.00 NIST
I 2034.00 NIST
I 2065.00 NIST
I 2039.00 NIST
I 2014.00 NIST
I 2042.00 NIST
I 2027.00 NIST
I 2044.00 NIST
I 2034.00 NIST
I 2025.00 NIST
I 2020.00 NIST
I 2033.00 NIST
I 2037.00 NIST
I 2000.00 NIST
I 2020.00 NIST
I 1991.00 NIST
I 2000.00 NIST
Tboil 636.31 K Joback Calculated Property
Tc 817.59 K Joback Calculated Property
Tfus 282.21 K Joback Calculated Property
Vc 0.827 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [575.19; 658.66] J/mol×K [636.31; 817.59] Show Hide
Cp,gas 575.19 J/mol×K 636.31 Joback Calculated Property
Cp,gas 591.00 J/mol×K 666.52 Joback Calculated Property
Cp,gas 605.97 J/mol×K 696.74 Joback Calculated Property
Cp,gas 620.16 J/mol×K 726.95 Joback Calculated Property
Cp,gas 633.63 J/mol×K 757.17 Joback Calculated Property
Cp,gas 646.44 J/mol×K 787.38 Joback Calculated Property
Cp,gas 658.66 J/mol×K 817.59 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr [386.00; 387.20] K [0.10; 0.10] Show Hide
Tboilr 387.20 K 0.10 NIST
Tboilr 386.00 ± 1.00 K 0.10 NIST

Similar Compounds

Nerolidol. 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (E)-. +/--trans-Nerolidol. Nerolidol isomer. 1,6,10,14-Hexadecatetraen-3-ol, 3,7,11,15-tetramethyl-, (E,E)-. (R)-linalool. ( S)-linalool. Linalool. 1,6,9-Dodecatrien-3-ol, 3,7,11-trimethyl-. Fokienol. (E,E)-Farnesa-1,6,9-trien-3,11-diol. 9-Hydroxynerolidol. 2,7-Octadiene-1,6-diol, 2,6-dimethyl-, (Z)-. 2,7-Octadiene-1,6-diol, 2,6-dimethyl-, (E)-. 2,7-Octadiene-1,6-diol, 2,6-dimethyl-.

Find more compounds similar to 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-.

Sources

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