Chemical Properties of 2,4-Dimethyl-3-pentanol acetate (CAS 84612-74-8)

InChI

InChI=1S/C9H18O2/c1-6(2)9(7(3)4)11-8(5)10/h6-7,9H,1-5H3

InChI Key

OXCWHEWLKNJJET-UHFFFAOYSA-N

Formula

C9H18O2

SMILES

CC(=O)OC(C(C)C)C(C)C

Molecular Weight¹

158.24

CAS

84612-74-8

Other Names

• Acetic acid, 2,4-dimethylpent-3-yl ester

• 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°	-216.34	kJ/mol	Joback Calculated Property
ΔfH°gas	-489.73	kJ/mol	Joback Calculated Property
ΔfusH°	11.28	kJ/mol	Joback Calculated Property
ΔvapH°	43.62	kJ/mol	Joback Calculated Property
log10WS	-2.08		Crippen Calculated Property
logPoct/wat	2.230		Crippen Calculated Property
McVol	145.110	ml/mol	McGowan Calculated Property
Pc	2470.27	kPa	Joback Calculated Property
Inp	[1032.00; 1032.00]
Inp	1032.00		NIST
Inp	1032.00		NIST
Tboil	480.29	K	Joback Calculated Property
Tc	665.27	K	Joback Calculated Property
Tfus	218.35	K	Joback Calculated Property
Vc	0.545	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[323.38; 401.02]	J/mol×K	[480.29; 665.27]
Cp,gas	323.38	J/mol×K	480.29	Joback Calculated Property
Cp,gas	337.72	J/mol×K	511.12	Joback Calculated Property
Cp,gas	351.50	J/mol×K	541.95	Joback Calculated Property
Cp,gas	364.71	J/mol×K	572.78	Joback Calculated Property
Cp,gas	377.36	J/mol×K	603.61	Joback Calculated Property
Cp,gas	389.47	J/mol×K	634.44	Joback Calculated Property
Cp,gas	401.02	J/mol×K	665.27	Joback Calculated Property
η	[0.0002047; 0.0122928]	Pa×s	[218.35; 480.29]
η	0.0122928	Pa×s	218.35	Joback Calculated Property
η	0.0035177	Pa×s	262.01	Joback Calculated Property
η	0.0014391	Pa×s	305.66	Joback Calculated Property
η	0.0007361	Pa×s	349.32	Joback Calculated Property
η	0.0004370	Pa×s	392.98	Joback Calculated Property
η	0.0002879	Pa×s	436.63	Joback Calculated Property
η	0.0002047	Pa×s	480.29	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,4-Dimethyl-3-pentanol acetate.

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.