Chemical Properties of Limonene oxide, trans- (CAS 4959-35-7)

InChI

InChI=1S/C10H16O/c1-7(2)8-4-5-10(3)9(6-8)11-10/h8-9H,1,4-6H2,2-3H3

InChI Key

CCEFMUBVSUDRLG-UHFFFAOYSA-N

Formula

C10H16O

SMILES

C=C(C)C1CCC2(C)OC2C1

Molecular Weight¹

152.23

CAS

4959-35-7

Other Names

• (E)-Limonene oxide
• 4-Isopropenyl-1-methyl-7-oxabicyclo[4.1.0]heptane-, (1«alpha»,4«beta»,6«alpha»)-
• trans-Limonene oxide
• trans-Limonene-1,2-epoxide-
• trans-Limonene epoxide
• trans-1,2-Limonene epoxide
• 7-Oxabicyclo(4.1.0)heptane, 1-methyl-4-(1-methylethenyl)-, (1R,4S,6S)-
• trans-1,2-Epoxy-p-menth-8-ene
• trans-limonene-1,2-oxide
• trans-Limonen-1,2-epoxide
• trans-Limonen oxide
• trans-1,2-limonene oxide
• trans-Limonene oxyde

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	122.69	kJ/mol	Joback Calculated Property
ΔfH°gas	-131.75	kJ/mol	Joback Calculated Property
ΔfusH°	15.99	kJ/mol	Joback Calculated Property
ΔvapH°	40.31	kJ/mol	Joback Calculated Property
log10WS	-2.72		Crippen Calculated Property
logPoct/wat	2.520		Crippen Calculated Property
McVol	131.610	ml/mol	McGowan Calculated Property
Pc	2944.08	kPa	Joback Calculated Property
Inp	[1106.00; 1151.00]
Inp	1125.00		NIST
Inp	1146.00		NIST
Inp	1139.00		NIST
Inp	1137.00		NIST
Inp	Outlier 1106.00		NIST
Inp	1129.00		NIST
Inp	Outlier 1109.00		NIST
Inp	1141.00		NIST
Inp	1134.00		NIST
Inp	1121.00		NIST
Inp	1121.00		NIST
Inp	1125.00		NIST
Inp	1127.00		NIST
Inp	1127.00		NIST
Inp	1139.00		NIST
Inp	1121.00		NIST
Inp	1147.00		NIST
Inp	1140.00		NIST
Inp	1138.00		NIST
Inp	1127.00		NIST
Inp	1139.00		NIST
Inp	1120.00		NIST
Inp	1120.00		NIST
Inp	1134.00		NIST
Inp	1120.00		NIST
Inp	1143.00		NIST
Inp	1143.00		NIST
Inp	1127.00		NIST
Inp	1127.00		NIST
Inp	1122.00		NIST
Inp	1125.00		NIST
Inp	1125.00		NIST
Inp	1139.00		NIST
Inp	1149.00		NIST
Inp	1138.00		NIST
Inp	Outlier 1151.00		NIST
Inp	1127.00		NIST
Inp	1112.00		NIST
Inp	1138.00		NIST
Inp	1121.00		NIST
Inp	1139.00		NIST
Inp	1121.00		NIST
Inp	1125.00		NIST
Inp	1122.00		NIST
Inp	1125.00		NIST
Inp	1142.00		NIST
Inp	1138.00		NIST
Inp	1139.00		NIST
Inp	1124.00		NIST
Inp	1126.00		NIST
Inp	1125.00		NIST
Inp	1142.00		NIST
Inp	1136.00		NIST
Inp	1133.00		NIST
Inp	1125.00		NIST
Inp	1125.00		NIST
Inp	1137.00		NIST
Inp	1125.00		NIST
Inp	1125.00		NIST
Inp	1123.00		NIST
Inp	1112.00		NIST
Inp	1139.00		NIST
Inp	1147.00		NIST
Inp	1138.00		NIST
Inp	1137.00		NIST
Inp	1123.00		NIST
Inp	1125.00		NIST
Inp	1129.00		NIST
I	[1420.00; 1482.00]
I	1459.00		NIST
I	1462.00		NIST
I	1439.00		NIST
I	1439.00		NIST
I	Outlier 1420.00		NIST
I	Outlier 1423.00		NIST
I	1480.00		NIST
I	1439.00		NIST
I	Outlier 1423.00		NIST
I	1466.00		NIST
I	1451.00		NIST
I	1441.00		NIST
I	1451.00		NIST
I	Outlier 1423.00		NIST
I	1453.00		NIST
I	1451.00		NIST
I	1467.00		NIST
I	1458.00		NIST
I	1470.00		NIST
I	1462.00		NIST
I	1463.00		NIST
I	1465.00		NIST
I	1481.00		NIST
I	1465.00		NIST
I	1472.00		NIST
I	1482.00		NIST
I	1437.00		NIST
I	1458.00		NIST
I	1472.00		NIST
I	1442.00		NIST
I	1468.00		NIST
I	1468.00		NIST
I	1468.00		NIST
I	1468.00		NIST
I	1468.00		NIST
I	1461.00		NIST
I	1468.00		NIST
I	1468.00		NIST
I	1468.00		NIST
Tboil	465.03	K	Joback Calculated Property
Tc	678.77	K	Joback Calculated Property
Tfus	265.33	K	Joback Calculated Property
Vc	0.501	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[303.56; 396.88]	J/mol×K	[465.03; 678.77]
Cp,gas	303.56	J/mol×K	465.03	Joback Calculated Property
Cp,gas	322.20	J/mol×K	500.65	Joback Calculated Property
Cp,gas	339.41	J/mol×K	536.28	Joback Calculated Property
Cp,gas	355.33	J/mol×K	571.90	Joback Calculated Property
Cp,gas	370.12	J/mol×K	607.52	Joback Calculated Property
Cp,gas	383.92	J/mol×K	643.14	Joback Calculated Property
Cp,gas	396.88	J/mol×K	678.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to Limonene oxide, trans-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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