Chemical Properties of cis-Linalool oxide, carbamate

InChI

InChI=1S/C11H19NO3/c1-5-11(4)7-6-8(14-11)10(2,3)15-9(12)13/h5,8H,1,6-7H2,2-4H3,(H2,12,13)/t8-,11-/m1/s1

InChI Key

FMWFOHCSIFNDTM-LDYMZIIASA-N

Formula

C11H19NO3

SMILES

C=CC1(C)CCC(C(C)(C)OC(N)=O)O1

Molecular Weight¹

213.27

• 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.
• 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°	-97.82	kJ/mol	Joback Calculated Property
ΔfH°gas	-441.32	kJ/mol	Joback Calculated Property
ΔfusH°	20.22	kJ/mol	Joback Calculated Property
ΔvapH°	61.22	kJ/mol	Joback Calculated Property
log10WS	-2.87		Crippen Calculated Property
logPoct/wat	1.984		Crippen Calculated Property
McVol	173.980	ml/mol	McGowan Calculated Property
Pc	2693.00	kPa	Joback Calculated Property
Inp	[1396.00; 1396.00]
Inp	1396.00		NIST
Inp	1396.00		NIST
Tboil	631.15	K	Joback Calculated Property
Tc	857.37	K	Joback Calculated Property
Tfus	426.94	K	Joback Calculated Property
Vc	0.633	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[484.03; 571.89]	J/mol×K	[631.15; 857.37]
Cp,gas	484.03	J/mol×K	631.15	Joback Calculated Property
Cp,gas	500.72	J/mol×K	668.85	Joback Calculated Property
Cp,gas	516.40	J/mol×K	706.56	Joback Calculated Property
Cp,gas	531.21	J/mol×K	744.26	Joback Calculated Property
Cp,gas	545.29	J/mol×K	781.96	Joback Calculated Property
Cp,gas	558.81	J/mol×K	819.66	Joback Calculated Property
Cp,gas	571.89	J/mol×K	857.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to cis-Linalool oxide, carbamate.

Sources

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

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