Chemical Properties of Neo-isopulegol (CAS 96612-21-4)

Neo-isopulegol

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InChI
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9+,10+/m0/s1
InChI Key
ZYTMANIQRDEHIO-IVZWLZJFSA-N
Formula
C10H18O
SMILES
C=C(C)C1CCC(C)CC1O
Molecular Weight1
154.25
CAS
96612-21-4
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Physical Properties

Property Value Unit Source
Δf -15.18 kJ/mol Joback Calculated Property
Δfgas -272.68 kJ/mol Joback Calculated Property
Δfus 17.13 kJ/mol Joback Calculated Property
Δvap 53.75 kJ/mol Joback Calculated Property
log10WS -2.65 Crippen Calculated Property
logPoct/wat 2.360 Crippen Calculated Property
McVol 142.470 ml/mol McGowan Calculated Property
Pc 2770.08 kPa Joback Calculated Property
Inp [1130.00; 1156.00]   Show Hide
Inp 1142.00 NIST
Inp 1144.00 NIST
Inp 1144.00 NIST
Inp 1150.00 NIST
Inp 1153.00 NIST
Inp 1146.00 NIST
Inp 1134.00 NIST
Inp 1143.00 NIST
Inp 1130.00 NIST
Inp 1156.00 NIST
Inp 1147.00 NIST
Inp 1145.00 NIST
Inp 1132.00 NIST
Inp 1153.00 NIST
Inp 1156.00 NIST
I [1562.00; 1574.00]   Show Hide
I 1568.00 NIST
I 1562.00 NIST
I 1574.00 NIST
I 1562.00 NIST
Tboil 527.15 K Joback Calculated Property
Tc 719.80 K Joback Calculated Property
Tfus 246.46 K Joback Calculated Property
Vc 0.527 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [350.71; 439.67] J/mol×K [527.15; 719.80] Show Hide
Cp,gas 350.71 J/mol×K 527.15 Joback Calculated Property
Cp,gas 367.51 J/mol×K 559.26 Joback Calculated Property
Cp,gas 383.50 J/mol×K 591.37 Joback Calculated Property
Cp,gas 398.69 J/mol×K 623.47 Joback Calculated Property
Cp,gas 413.11 J/mol×K 655.58 Joback Calculated Property
Cp,gas 426.76 J/mol×K 687.69 Joback Calculated Property
Cp,gas 439.67 J/mol×K 719.80 Joback Calculated Property

Similar Compounds

Pulegol. dl-Isopulegol. dl-Isopulegol. Isopulegol. Cyclohexanol, 5-methyl-2-(1-methylethenyl)-. Epi-isopulegol (methyl axial). (+)-(4S,5R,6R,7S,10S)-6«beta»-Hydroxyeudesmen-11-ene. (-)-(4S,5R,6S,7R,10S)-6«alpha»-Hydroxyeudesmen-11-ene. (-)-6«alpha»-Hydroxy-eudesm-11-ene. (+)-6«beta»-Hydroxy-eudesm-11-ene. Eudesm-4(15)-ene-6-ol. Junenol. trans-Dihydrocarveol. Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, (1«alpha»,2«alpha»,5«beta»)-. Dihydro carveol <neo,iso>.

Find more compounds similar to Neo-isopulegol.

Sources

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