Chemical Properties of 4-Acetyl-1-methylcyclohexene (CAS 6090-09-1)

InChI

InChI=1S/C9H14O/c1-7-3-5-9(6-4-7)8(2)10/h3,9H,4-6H2,1-2H3

InChI Key

HOBBEYSRFFJETF-UHFFFAOYSA-N

Formula

C9H14O

SMILES

CC(=O)C1CC=C(C)CC1

Molecular Weight¹

138.21

CAS

6090-09-1

Other Names

• 4-Acetyl-1-methyl-1-cyclohexene
• Ethanone, 1-(4-methyl-3-cyclohexen-1-yl)-
• 1-(4-Methyl-3-cyclohexen-1-yl)ethanone
• 1-Methyl-4-acetylcyclohex-1-ene
• 4-Acetyl-1-methylcyclohex-1-ene
• Cyclohexene, 1-methyl-4-acetyl
• Cyclohexene, 4-acetyl-1-methyl
• Ketone, methyl 4-methyl-3-cyclohexen-1-yl
• Methyl 4-methyl-3-cyclohexen-1-yl ketone
• Limona ketone
• 4-Methyl-3-cyclohexen-1-yl methyl ketone

• 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.
• 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°	-59.24	kJ/mol	Joback Calculated Property
ΔfH°gas	-241.04	kJ/mol	Joback Calculated Property
ΔfusH°	13.33	kJ/mol	Joback Calculated Property
ΔvapH°	43.76	kJ/mol	Joback Calculated Property
log10WS	-2.38		Crippen Calculated Property
logPoct/wat	2.322		Crippen Calculated Property
McVol	124.080	ml/mol	McGowan Calculated Property
Pc	3110.57	kPa	Joback Calculated Property
Inp	[1105.00; 1147.00]
Inp	1131.20		NIST
Inp	1147.00		NIST
Inp	1105.00		NIST
Inp	1144.00		NIST
Inp	1114.00		NIST
Inp	1135.00		NIST
Inp	1137.00		NIST
I	[1568.00; 1570.00]
I	1568.00		NIST
I	Outlier 1570.00		NIST
I	1568.00		NIST
I	1568.00		NIST
I	1568.00		NIST
I	1568.00		NIST
I	1568.00		NIST
I	1568.00		NIST
I	1568.00		NIST
I	1568.00		NIST
Tboil	482.88	K	Joback Calculated Property
Tc	696.61	K	Joback Calculated Property
Tfus	261.78	K	Joback Calculated Property
Vc	0.465	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[266.91; 349.96]	J/mol×K	[482.88; 696.61]
Cp,gas	266.91	J/mol×K	482.88	Joback Calculated Property
Cp,gas	282.78	J/mol×K	518.50	Joback Calculated Property
Cp,gas	297.81	J/mol×K	554.12	Joback Calculated Property
Cp,gas	312.02	J/mol×K	589.75	Joback Calculated Property
Cp,gas	325.44	J/mol×K	625.37	Joback Calculated Property
Cp,gas	338.08	J/mol×K	660.99	Joback Calculated Property
Cp,gas	349.96	J/mol×K	696.61	Joback Calculated Property
η	[0.0002935; 0.0032877]	Pa×s	[261.78; 482.88]
η	0.0032877	Pa×s	261.78	Joback Calculated Property
η	0.0017144	Pa×s	298.63	Joback Calculated Property
η	0.0010315	Pa×s	335.48	Joback Calculated Property
η	0.0006862	Pa×s	372.33	Joback Calculated Property
η	0.0004913	Pa×s	409.18	Joback Calculated Property
η	0.0003717	Pa×s	446.03	Joback Calculated Property
η	0.0002935	Pa×s	482.88	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Acetyl-1-methylcyclohexene.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.