Chemical Properties of 3-Hexene, 2-methyl-, (E)- (CAS 692-24-0)

InChI

InChI=1S/C7H14/c1-4-5-6-7(2)3/h5-7H,4H2,1-3H3/b6-5+

InChI Key

IQANHWBWTVLDTP-AATRIKPKSA-N

Formula

C7H14

SMILES

CCC=CC(C)C

Molecular Weight¹

98.19

CAS

692-24-0

Other Names

• (E)-2-METHYL-3-HEXENE
• (E)-2-methylhex-3-ene
• (E)-3-Hexene, 2-methyl
• 2-METHYL-TRANS-3-HEXENE
• 2-Methyl-3-hexene, trans
• TRANS-2-METHYL-3-HEXENE

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• P_vap : Vapor 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°	85.84	kJ/mol	Joback Calculated Property
ΔfH°gas	-75.87	kJ/mol	Joback Calculated Property
ΔfusH°	10.56	kJ/mol	Joback Calculated Property
ΔvapH°	34.30	kJ/mol	NIST
log10WS	-2.36		Crippen Calculated Property
logPoct/wat	2.609		Crippen Calculated Property
McVol	105.190	ml/mol	McGowan Calculated Property
Pc	2986.06	kPa	Joback Calculated Property
Inp	[647.00; 664.00]
Inp	660.50		NIST
Inp	647.40		NIST
Inp	660.00		NIST
Inp	660.00		NIST
Inp	648.00		NIST
Inp	647.00		NIST
Inp	649.10		NIST
Inp	649.40		NIST
Inp	647.00		NIST
Inp	647.00		NIST
Inp	656.00		NIST
Inp	648.00		NIST
Inp	648.00		NIST
Inp	647.00		NIST
Inp	647.00		NIST
Inp	647.00		NIST
Inp	647.00		NIST
Inp	647.00		NIST
Inp	661.00		NIST
Inp	664.00		NIST
Inp	661.10		NIST
Inp	647.20		NIST
Inp	647.00		NIST
Inp	660.00		NIST
Inp	651.00		NIST
Inp	656.00		NIST
Inp	661.00		NIST
Inp	660.00		NIST
Inp	660.00		NIST
Tboil	[359.02; 367.10]	K
Tboil	359.10	K	NIST
Tboil	359.02 ± 0.20	K	NIST
Tboil	359.07 ± 0.30	K	NIST
Tboil	359.07 ± 0.30	K	NIST
Tboil	367.10 ± 0.50	K	NIST
Tc	539.72	K	Joback Calculated Property
Tfus	148.57	K	Joback Calculated Property
Vc	0.402	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[180.16; 245.01]	J/mol×K	[363.28; 539.72]
Cp,gas	180.16	J/mol×K	363.28	Joback Calculated Property
Cp,gas	192.22	J/mol×K	392.69	Joback Calculated Property
Cp,gas	203.76	J/mol×K	422.09	Joback Calculated Property
Cp,gas	214.79	J/mol×K	451.50	Joback Calculated Property
Cp,gas	225.33	J/mol×K	480.91	Joback Calculated Property
Cp,gas	235.39	J/mol×K	510.31	Joback Calculated Property
Cp,gas	245.01	J/mol×K	539.72	Joback Calculated Property
η	[0.0001915; 0.0095853]	Pa×s	[148.57; 363.28]
η	0.0095853	Pa×s	148.57	Joback Calculated Property
η	0.0026515	Pa×s	184.35	Joback Calculated Property
η	0.0011138	Pa×s	220.14	Joback Calculated Property
η	0.0005963	Pa×s	255.92	Joback Calculated Property
η	0.0003722	Pa×s	291.71	Joback Calculated Property
η	0.0002575	Pa×s	327.50	Joback Calculated Property
η	0.0001915	Pa×s	363.28	Joback Calculated Property
ΔvapH	33.50	kJ/mol	348.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[261.46; 383.71]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.39948e+01
Coefficient B			-2.89637e+03
Coefficient C			-5.01530e+01
Temperature range, min.			261.46
Temperature range, max.			383.71
Pvap	1.33	kPa	261.46	Calculated Property
Pvap	3.05	kPa	275.04	Calculated Property
Pvap	6.36	kPa	288.63	Calculated Property
Pvap	12.23	kPa	302.21	Calculated Property
Pvap	22.01	kPa	315.79	Calculated Property
Pvap	37.41	kPa	329.38	Calculated Property
Pvap	60.53	kPa	342.96	Calculated Property
Pvap	93.84	kPa	356.54	Calculated Property
Pvap	140.18	kPa	370.13	Calculated Property
Pvap	202.66	kPa	383.71	Calculated Property

Similar Compounds

Find more compounds similar to 3-Hexene, 2-methyl-, (E)-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• KDB
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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