Chemical Properties of Ledol (CAS 577-27-5)

Ledol

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InChI
InChI=1S/C15H26O/c1-9-5-6-10-12(9)13-11(14(13,2)3)7-8-15(10,4)16/h9-13,16H,5-8H2,1-4H3/t9-,10?,11?,12?,13?,15-/m1/s1
InChI Key
AYXPYQRXGNDJFU-XJMMWPIVSA-N
Formula
C15H26O
SMILES
CC1CCC2C1C1C(CCC2(C)O)C1(C)C
Molecular Weight1
222.37
CAS
577-27-5
Other Names
  • 1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, [1ar-(1a«alpha»,4«alpha»,4a«beta»,7«alpha»,7a«beta»,7b«alpha»)]-
  • 1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, (1ar,4R,4as,7R,7as,7bs)-
  • (+)-Ledol
  • d-Ledol
  • 1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, [1ar-(1a«alpha»,4«alpha»,4a«beta»,7«beta»,7a«beta»,7b«alpha»)]-
  • (1aS,4S,4aR,7S,7aR,7bR)-1,1,4,7-Tetramethyldecahydro-1H-cyclopropa[e]azulen-4-ol
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Physical Properties

Property Value Unit Source
Δf 54.83 kJ/mol Joback Calculated Property
Δfgas -349.96 kJ/mol Joback Calculated Property
Δfus 20.59 kJ/mol Joback Calculated Property
Δvap 62.21 kJ/mol Joback Calculated Property
log10WS -3.71 Crippen Calculated Property
logPoct/wat 3.466 Crippen Calculated Property
McVol 195.500 ml/mol McGowan Calculated Property
Pc 2127.56 kPa Joback Calculated Property
Inp [1539.00; 1616.00]   Show Hide
Inp 1599.00 NIST
Inp 1599.00 NIST
Inp 1573.00 NIST
Inp 1565.00 NIST
Inp 1560.00 NIST
Inp 1569.00 NIST
Inp 1565.00 NIST
Inp 1542.00 NIST
Inp 1546.00 NIST
Inp 1605.00 NIST
Inp 1551.00 NIST
Inp 1561.00 NIST
Inp 1551.00 NIST
Inp 1586.00 NIST
Inp 1551.00 NIST
Inp 1584.00 NIST
Inp 1563.00 NIST
Inp 1580.00 NIST
Inp 1549.00 NIST
Inp 1564.00 NIST
Inp 1549.00 NIST
Inp 1597.00 NIST
Inp 1565.00 NIST
Inp 1561.00 NIST
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Inp 1567.00 NIST
Inp 1547.00 NIST
Inp 1582.00 NIST
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Inp 1551.00 NIST
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Inp 1566.00 NIST
Inp 1600.00 NIST
Inp 1597.00 NIST
Inp 1586.00 NIST
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Inp 1569.00 NIST
Inp 1565.00 NIST
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Inp 1591.00 NIST
Inp 1608.00 NIST
Inp 1570.00 NIST
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Inp 1565.00 NIST
Inp Outlier 1616.00 NIST
Inp 1562.00 NIST
Inp 1607.00 NIST
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Inp 1567.00 NIST
Inp 1552.00 NIST
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Inp 1560.00 NIST
Inp 1563.00 NIST
Inp 1560.00 NIST
Inp 1564.00 NIST
Inp 1601.00 NIST
Inp 1554.00 NIST
Inp Outlier 1539.00 NIST
Inp 1582.00 NIST
Inp 1559.00 NIST
Inp 1561.00 NIST
Inp 1568.00 NIST
Inp 1600.00 NIST
Inp 1563.00 NIST
Inp 1593.00 NIST
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Inp 1562.00 NIST
Inp 1562.00 NIST
Inp 1547.00 NIST
Inp 1559.00 NIST
Inp 1601.00 NIST
Inp 1554.00 NIST
Inp 1560.00 NIST
Inp 1565.00 NIST
Inp 1600.00 NIST
Inp 1600.00 NIST
Inp 1598.00 NIST
Inp 1565.00 NIST
Inp 1565.00 NIST
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Inp 1592.00 NIST
Inp 1561.00 NIST
Inp 1567.00 NIST
Inp 1565.00 NIST
Inp 1565.00 NIST
Inp 1566.00 NIST
Inp 1550.00 NIST
Inp Outlier 1539.00 NIST
Inp 1562.00 NIST
Inp 1601.00 NIST
Inp 1597.00 NIST
Inp 1560.00 NIST
Inp 1585.00 NIST
Inp 1575.00 NIST
Inp 1575.00 NIST
Inp 1575.00 NIST
Inp 1580.00 NIST
Inp 1568.00 NIST
Inp 1595.00 NIST
Inp 1585.00 NIST
Inp 1596.00 NIST
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Inp 1590.00 NIST
Inp 1604.00 NIST
Inp 1608.00 NIST
Inp 1565.00 NIST
Inp 1551.00 NIST
Inp 1572.00 NIST
Inp 1565.00 NIST
Inp 1565.00 NIST
Inp 1595.00 NIST
Inp 1565.00 NIST
Inp 1580.00 NIST
Inp 1580.00 NIST
Inp 1580.00 NIST
Inp 1569.00 NIST
Inp 1565.00 NIST
Inp 1587.00 NIST
Inp 1588.00 NIST
Inp 1579.00 NIST
Inp 1580.00 NIST
Inp 1565.00 NIST
Inp 1582.00 NIST
Inp 1565.00 NIST
Inp 1583.00 NIST
Inp 1551.00 NIST
Inp 1580.00 NIST
Inp 1593.00 NIST
Inp 1581.00 NIST
Inp 1590.00 NIST
Inp 1597.00 NIST
Inp 1547.00 NIST
Inp 1588.00 NIST
Inp 1586.00 NIST
Inp 1585.00 NIST
Inp 1580.00 NIST
Inp 1570.00 NIST
I [1997.00; 2064.00]   Show Hide
I 2043.00 NIST
I 2035.00 NIST
I 2024.00 NIST
I Outlier 1997.00 NIST
I 2035.00 NIST
I 2016.00 NIST
I 2062.00 NIST
I 2014.00 NIST
I 2032.00 NIST
I 2062.00 NIST
I 2021.00 NIST
I 2026.00 NIST
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I 2030.00 NIST
I 2030.00 NIST
I Outlier 1997.00 NIST
I 2007.00 NIST
I 2064.00 NIST
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I 2030.00 NIST
I 2021.00 NIST
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I 2028.00 NIST
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I 2060.00 NIST
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I 2057.00 NIST
I 2057.00 NIST
I 2057.00 NIST
I 2057.00 NIST
I 2057.00 NIST
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I 2057.00 NIST
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Tboil 645.34 K Joback Calculated Property
Tc 851.43 K Joback Calculated Property
Tfus 397.25 K Joback Calculated Property
Vc 0.742 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [600.58; 713.82] J/mol×K [645.34; 851.43] Show Hide
Cp,gas 600.58 J/mol×K 645.34 Joback Calculated Property
Cp,gas 621.09 J/mol×K 679.69 Joback Calculated Property
Cp,gas 640.66 J/mol×K 714.04 Joback Calculated Property
Cp,gas 659.50 J/mol×K 748.38 Joback Calculated Property
Cp,gas 677.83 J/mol×K 782.73 Joback Calculated Property
Cp,gas 695.86 J/mol×K 817.08 Joback Calculated Property
Cp,gas 713.82 J/mol×K 851.43 Joback Calculated Property

Similar Compounds

Epiglobulol. Globulol. (1aR,4S,4aR,7R,7aS,7bS)-1,1,4,7-Tetramethyldecahydro-1H-cyclopropa[e]azulen-4-ol. Ledol, isomer 2. (-)-Ledol. (-)-Globulol. 1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, [1aR-(1a«alpha»,4«beta»,4a«beta»,7«alpha»,7a«beta»,7b«alpha»)]-. Ledol, isomer 1. 4aH-Cycloprop[e]azulen-4a-ol, decahydro-1,1,4,7-tetramethyl-, [1aR-(1a«alpha»,4«beta»,4a«beta»,7«alpha»,7a«beta»,7b«alpha»)]-. (-)-4-epi-Maaliol. Maaliol. 2-((3R,3aR,3bS,4R,7R,7aS)-3,7-Dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzen-4-yl)propan-2-ol. Cubeban-11-ol. 1-epi-Cubebol. (3S,3aR,3bR,4S,7R,7aR)-4-Isopropyl-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzen-3-ol.

Find more compounds similar to Ledol.

Sources

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