Chemical Properties of 1-Propene, 3-methoxy- (CAS 627-40-7)

InChI

InChI=1S/C4H8O/c1-3-4-5-2/h3H,1,4H2,2H3

InChI Key

FASUFOTUSHAIHG-UHFFFAOYSA-N

Formula

C4H8O

SMILES

C=CCOC

Molecular Weight¹

72.11

CAS

627-40-7

Other Names

• 1-Methoxy-2-propene
• 3-Methoxy-1-propene
• 3-Methoxypropene
• 4-Oxapent-1-ene
• Allyl methyl ether
• CH2=CHCH2OCH3
• Ether, allyl methyl
• Methyl 2-propenyl ether
• Methyl allyl ether

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.2315		Relay (1.0) Calculated Property
ΔfG°	-34.36	kJ/mol	Joback Calculated Property
ΔfH°gas	-92.92	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	6.02	kJ/mol	Joback Calculated Property
ΔvapH°	27.04	kJ/mol	Relay (1.0) Calculated Property
IE	[9.56; 9.84]	eV
IE	9.56	eV	NIST
IE	9.84 ± 0.05	eV	NIST
log10WS	-0.21		Relay (1.0) Calculated Property
logPoct/wat	0.819		Crippen Calculated Property
McVol	68.790	ml/mol	McGowan Calculated Property
Pc	4021.02	kPa	Joback Calculated Property
Inp	[529.00; 529.00]
Inp	529.00		NIST
Inp	529.00		NIST
Tboil	[319.15; 320.00]	K
Tboil	319.20	K	NIST
Tboil	319.15 ± 2.00	K	NIST
Tboil	320.00 ± 3.00	K	NIST
Tc	470.34	K	Relay (1.0) Calculated Property
Tfus	136.76	K	Relay (1.0) Calculated Property
Vc	0.233	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[104.77; 141.00]	J/mol×K	[310.02; 477.00]
Cp,gas	104.77	J/mol×K	310.02	Joback Calculated Property
Cp,gas	111.22	J/mol×K	337.85	Joback Calculated Property
Cp,gas	117.51	J/mol×K	365.68	Joback Calculated Property
Cp,gas	123.63	J/mol×K	393.51	Joback Calculated Property
Cp,gas	129.59	J/mol×K	421.34	Joback Calculated Property
Cp,gas	135.37	J/mol×K	449.17	Joback Calculated Property
Cp,gas	141.00	J/mol×K	477.00	Joback Calculated Property
η	[0.0001825; 0.0019925]	Pa×s	[155.31; 310.02]
η	0.0019925	Pa×s	155.31	Joback Calculated Property
η	0.0010073	Pa×s	181.09	Joback Calculated Property
η	0.0006037	Pa×s	206.88	Joback Calculated Property
η	0.0004052	Pa×s	232.66	Joback Calculated Property
η	0.0002945	Pa×s	258.45	Joback Calculated Property
η	0.0002268	Pa×s	284.24	Joback Calculated Property
η	0.0001825	Pa×s	310.02	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[234.72; 327.08]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.64842e+01
Coefficient B			-3.32682e+03
Coefficient C			-2.93180e+01
Temperature range, min.			234.72
Temperature range, max.			327.08
Pvap	1.33	kPa	234.72	Calculated Property
Pvap	2.88	kPa	244.98	Calculated Property
Pvap	5.81	kPa	255.24	Calculated Property
Pvap	11.01	kPa	265.51	Calculated Property
Pvap	19.79	kPa	275.77	Calculated Property
Pvap	33.95	kPa	286.03	Calculated Property
Pvap	55.87	kPa	296.29	Calculated Property
Pvap	88.62	kPa	306.56	Calculated Property
Pvap	136.00	kPa	316.82	Calculated Property
Pvap	202.64	kPa	327.08	Calculated Property

Similar Compounds

Find more compounds similar to 1-Propene, 3-methoxy-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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