Chemical Properties of Limonene (CAS 7705-14-8)

Limonene

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InChI
InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3
InChI Key
XMGQYMWWDOXHJM-UHFFFAOYSA-N
Formula
C10H16
SMILES
C=C(C)C1CC=C(C)CC1
Molecular Weight1
136.23
CAS
7705-14-8
Other Names
  • ( R/ S)-limonene
  • (+)-(4R)-limonene
  • (+)-limonene
  • (.+/-.)-Dipentene
  • (.+/-.)-Limonene
  • (.+/-.)-«alpha»-Limonene
  • (R)-(+)-Limonene
  • (R)-Limonene
  • (±)-limonene
  • 1,8(9)-p-Menthadiene
  • 1,8-p-Menthadiene
  • 1-Methyl-4-(1-methylethenyl)cyclohexene
  • 1-Methyl-4-isopropenyl-1-cyclohexene
  • 1-Methyl-4-isopropenylcyclohexene
  • 1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene
  • 1-methyl-4-isopropenylcyclohex-1-ene
  • 1-methyl-4-isopropenylcyclohex-1-ene (limonene)
  • 4-Isopropenyl-1-methyl-1-cyclohexene
  • 4-Isopropenyl-1-methylcyclohexene
  • Achilles dipentene
  • Acintene DP
  • Acintene DP dipentene
  • Cajeputen
  • Cajeputene
  • Cinen
  • Cinene
  • Cyclohexene, 1-methyl-4-(1-methylethenyl)-
  • Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (.+/-.)-
  • Cyclohexene, 1-methyl-4-(1-methylethynyl)
  • D-Limonene
  • DL-Limonene
  • Di-p-mentha-1,8-diene
  • Dipanol
  • Dipenten
  • Dipentene
  • Dipentene limonene
  • Eulimen
  • Flavor orange
  • Goldflush II
  • Inactive limonene
  • Kautschin
  • Limonen
  • Limonene [4R-(+), 4S-(-)]
  • Limonene+
  • NSC 21446
  • Nesol
  • Orange flavor
  • PC 560
  • UN 2052
  • Unitene
  • dipentene (p-Mentha-1,8-diene)
  • p-Mentha-1,8(9)-diene
  • p-Mentha-1,8-diene
  • p-Mentha-1,8-diene, dl-
  • «alpha»-Limonene
  • «delta»-1,8-Terpodiene
Sources

Physical Properties

Property Value Unit Source
Δcliquid -6171.00 ± 2.10 kJ/mol NIST
Δf 157.39 kJ/mol Joback Calculated Property
Δfgas -33.46 kJ/mol Joback Calculated Property
Δfus 11.73 kJ/mol Joback Calculated Property
Δvap 38.65 kJ/mol Joback Calculated Property
logPoct/wat 3.309 Crippen Calculated Property
Pc 2755.56 kPa Joback Calculated Property
Tboil 451.20 K NIST
Tboil 449.15 ± 1.00 K NIST
Tc 657.16 K Joback Calculated Property
Tfus 207.40 K Joback Calculated Property
Vc 0.496 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 269.80 J/mol×K 448.45 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< 1
=CH- (ring) 1
=CH2 1
=C< (ring) 1
-CH3 2
>CH- (ring) 1
-CH2- (ring) 3

Similar Compounds

D-Limonene. Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (S)-. Limonene. Bisabolene. (E)- «beta»-Bisabolene. «beta»-Bisabolene. (+)-Helminthogermacrene. Helmintogermacrene. (+)-(7S)-Helmintogermacrene. (+)-Germacrene A. (R,1E,5E,9E)-1,5,9-Trimethyl-12-(prop-1-en-2-yl)cyclotetradeca-1,5,9-triene. Germacrene A. (+)-Axinyssene. Cyclohexene, 1,2-dimethyl-4-(1-methylethenyl). p-Camphorene.

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