Chemical Properties of Limonene (CAS 138-86-3)

Limonene

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

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
138-86-3
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 -6128.30 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
IE 8.30 eV NIST
logPoct/wat 3.309 Crippen Calculated Property
Pc 2755.56 kPa Joback Calculated Property
Tboil [448.00; 454.00] K Show Hide
Tboil 448.20 K NIST
Tboil 448.00 ± 4.00 K NIST
Tboil 450.75 ± 0.35 K NIST
Tboil 449.85 ± 0.30 K NIST
Tboil 448.00 ± 4.00 K NIST
Tboil 451.00 ± 4.00 K NIST
Tboil 450.00 ± 4.00 K NIST
Tboil 450.00 ± 6.00 K NIST
Tboil 450.00 ± 5.00 K NIST
Tboil 452.00 ± 4.00 K NIST
Tboil 454.00 ± 4.00 K NIST
Tboil 451.00 ± 4.00 K NIST
Tboil 454.00 ± 4.00 K NIST
Tc 657.16 K Joback Calculated Property
Tfus 184.12 ± 0.10 K NIST
Tfus 177.65 ± 0.30 K NIST
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
Cp,liquid 249.40 J/mol×K 293.3 NIST
Cp,liquid 249.40 J/mol×K 293.4 NIST
ΔvapH 45.90 kJ/mol 367.5 NIST
ΔvapH 39.40 kJ/mol 379.0 NIST

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

Limonene. D-Limonene. Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (S)-. 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.

Find more compounds similar to Limonene.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.