Chemical Properties of 3-Hexyl-oxirane-2-carboxylic acid methyl ester

InChI

InChI=1S/C10H18O3/c1-3-4-5-6-7-8-9(13-8)10(11)12-2/h8-9H,3-7H2,1-2H3

InChI Key

CYFDJMXHODROJG-UHFFFAOYSA-N

Formula

C10H18O3

SMILES

CCCCCCC1OC1C(=O)OC

Molecular Weight¹

186.25

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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°	-233.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-574.07	kJ/mol	Joback Calculated Property
ΔfusH°	31.63	kJ/mol	Joback Calculated Property
ΔvapH°	51.12	kJ/mol	Joback Calculated Property
log10WS	-2.08		Crippen Calculated Property
logPoct/wat	1.897		Crippen Calculated Property
McVol	154.210	ml/mol	McGowan Calculated Property
Pc	2393.53	kPa	Joback Calculated Property
Inp	[1294.00; 1294.00]
Inp	1294.00		NIST
Inp	1294.00		NIST
Tboil	533.51	K	Joback Calculated Property
Tc	717.59	K	Joback Calculated Property
Tfus	314.89	K	Joback Calculated Property
Vc	0.597	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[386.72; 466.33]	J/mol×K	[533.51; 717.59]
Cp,gas	386.72	J/mol×K	533.51	Joback Calculated Property
Cp,gas	401.63	J/mol×K	564.19	Joback Calculated Property
Cp,gas	415.86	J/mol×K	594.87	Joback Calculated Property
Cp,gas	429.42	J/mol×K	625.55	Joback Calculated Property
Cp,gas	442.34	J/mol×K	656.23	Joback Calculated Property
Cp,gas	454.64	J/mol×K	686.91	Joback Calculated Property
Cp,gas	466.33	J/mol×K	717.59	Joback Calculated Property
η	[0.0005189; 0.0021260]	Pa×s	[314.89; 533.51]
η	0.0021260	Pa×s	314.89	Joback Calculated Property
η	0.0014878	Pa×s	351.33	Joback Calculated Property
η	0.0011135	Pa×s	387.76	Joback Calculated Property
η	0.0008759	Pa×s	424.20	Joback Calculated Property
η	0.0007156	Pa×s	460.64	Joback Calculated Property
η	0.0006023	Pa×s	497.07	Joback Calculated Property
η	0.0005189	Pa×s	533.51	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Hexyl-oxirane-2-carboxylic acid methyl ester.

Sources

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

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.