Chemical Properties of 2-Hydroxy-cyclohexanecarboxylic acid ethyl ester, trans

InChI

InChI=1S/C9H16O3/c1-2-12-9(11)7-5-3-4-6-8(7)10/h7-8,10H,2-6H2,1H3/t7-,8-/m1/s1

InChI Key

WOGRTPJVNNCUKN-HTQZYQBOSA-N

Formula

C9H16O3

SMILES

CCOC(=O)C1CCCCC1O

Molecular Weight¹

172.22

• 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°	-329.10	kJ/mol	Joback Calculated Property
ΔfH°gas	-592.14	kJ/mol	Joback Calculated Property
ΔfusH°	18.85	kJ/mol	Joback Calculated Property
ΔvapH°	61.58	kJ/mol	Joback Calculated Property
log10WS	-1.48		Crippen Calculated Property
logPoct/wat	1.101		Crippen Calculated Property
McVol	140.120	ml/mol	McGowan Calculated Property
Pc	3184.73	kPa	Joback Calculated Property
Inp	[1196.00; 1275.00]
Inp	1275.00		NIST
Inp	1196.00		NIST
Tboil	588.67	K	Joback Calculated Property
Tc	783.67	K	Joback Calculated Property
Tfus	327.31	K	Joback Calculated Property
Vc	0.514	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[370.23; 446.71]	J/mol×K	[588.67; 783.67]
Cp,gas	370.23	J/mol×K	588.67	Joback Calculated Property
Cp,gas	384.80	J/mol×K	621.17	Joback Calculated Property
Cp,gas	398.64	J/mol×K	653.67	Joback Calculated Property
Cp,gas	411.74	J/mol×K	686.17	Joback Calculated Property
Cp,gas	424.12	J/mol×K	718.67	Joback Calculated Property
Cp,gas	435.77	J/mol×K	751.17	Joback Calculated Property
Cp,gas	446.71	J/mol×K	783.67	Joback Calculated Property
η	[0.0001062; 0.0073369]	Pa×s	[327.31; 588.67]
η	0.0073369	Pa×s	327.31	Joback Calculated Property
η	0.0023928	Pa×s	370.87	Joback Calculated Property
η	0.0009877	Pa×s	414.43	Joback Calculated Property
η	0.0004824	Pa×s	457.99	Joback Calculated Property
η	0.0002668	Pa×s	501.55	Joback Calculated Property
η	0.0001623	Pa×s	545.11	Joback Calculated Property
η	0.0001062	Pa×s	588.67	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Hydroxy-cyclohexanecarboxylic acid ethyl ester, trans.

Sources

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

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