Chemical Properties of Linalool-3,7-oxide

InChI

InChI=1S/C10H18O/c1-5-10(4)8-6-7-9(2,3)11-10/h5H,1,6-8H2,2-4H3

InChI Key

NETOHYFTCONTDT-UHFFFAOYSA-N

Formula

C10H18O

SMILES

C=CC1(C)CCCC(C)(C)O1

Molecular Weight¹

154.25

• 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 : 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°	40.80	kJ/mol	Joback Calculated Property
ΔfH°gas	-191.84	kJ/mol	Joback Calculated Property
ΔfusH°	8.66	kJ/mol	Joback Calculated Property
ΔvapH°	39.51	kJ/mol	Joback Calculated Property
log10WS	-3.07		Crippen Calculated Property
logPoct/wat	2.910		Crippen Calculated Property
McVol	142.470	ml/mol	McGowan Calculated Property
Pc	2820.33	kPa	Joback Calculated Property
I	[1109.00; 1111.00]
I	1111.00		NIST
I	1109.00		NIST
Tboil	467.19	K	Joback Calculated Property
Tc	685.50	K	Joback Calculated Property
Tfus	278.21	K	Joback Calculated Property
Vc	0.525	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[317.94; 414.58]	J/mol×K	[467.19; 685.50]
Cp,gas	317.94	J/mol×K	467.19	Joback Calculated Property
Cp,gas	337.17	J/mol×K	503.58	Joback Calculated Property
Cp,gas	354.87	J/mol×K	539.96	Joback Calculated Property
Cp,gas	371.27	J/mol×K	576.35	Joback Calculated Property
Cp,gas	386.55	J/mol×K	612.73	Joback Calculated Property
Cp,gas	400.92	J/mol×K	649.12	Joback Calculated Property
Cp,gas	414.58	J/mol×K	685.50	Joback Calculated Property

Similar Compounds

Find more compounds similar to Linalool-3,7-oxide.

Sources

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

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