Chemical Properties of Propane, 1,3-dimethoxy-

InChI

InChI=1S/C5H12O2/c1-6-4-3-5-7-2/h3-5H2,1-2H3

InChI Key

UUAMLBIYJDPGFU-UHFFFAOYSA-N

Formula

C5H12O2

SMILES

COCCCOC

Molecular Weight¹

104.15

Other Names

• Trimethylene glycol dimethyl ether
• 1,3-Dimethoxypropane
• CH3O(CH2)3OCH3

• ω : Acentric Factor.
• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• 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).
• 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	0.4044		Relay (1.0) Calculated Property
PAff	897.20	kJ/mol	NIST
BasG	858.60	kJ/mol	NIST
ΔfG°	-218.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-376.29	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	11.08	kJ/mol	Joback Calculated Property
ΔvapH°	40.11	kJ/mol	Relay (1.0) Calculated Property
IE	[9.30; 9.68]	eV
IE	9.30	eV	NIST
IE	9.68	eV	NIST
log10WS	0.04		Relay (1.0) Calculated Property
logPoct/wat	0.669		Crippen Calculated Property
McVol	93.050	ml/mol	McGowan Calculated Property
Pc	3333.53	kPa	Joback Calculated Property
Inp	[697.30; 700.00]
Inp	697.30		NIST
Inp	700.00		NIST
Inp	697.30		NIST
Tboil	385.22	K	Relay (1.0) Calculated Property
Tc	554.49	K	Relay (1.0) Calculated Property
Tfus	195.00	K	Relay (1.0) Calculated Property
Vc	0.346	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[142.36; 314.28]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			4.93430e+01
Coefficient B			3.52440e-01
Coefficient C			-2.62000e-05
Coefficient D			-6.13000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	142.36	J/mol×K	273.00	Calculated Property
Cp,gas	168.04	J/mol×K	353.78	Calculated Property
Cp,gas	192.52	J/mol×K	434.56	Calculated Property
Cp,gas	215.62	J/mol×K	515.33	Calculated Property
Cp,gas	237.14	J/mol×K	596.11	Calculated Property
Cp,gas	256.89	J/mol×K	676.89	Calculated Property
Cp,gas	274.67	J/mol×K	757.67	Calculated Property
Cp,gas	290.29	J/mol×K	838.44	Calculated Property
Cp,gas	303.56	J/mol×K	919.22	Calculated Property
Cp,gas	314.28	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0025228; 0.0001898]	Pa×s	[190.57; 367.07]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.13632e+01
Coefficient B			1.02542e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			190.57
Temperature range, max.			367.07
η	0.0025228	Pa×s	190.57	Calculated Property
η	0.0015270	Pa×s	210.18	Calculated Property
η	0.0010070	Pa×s	229.79	Calculated Property
η	0.0007090	Pa×s	249.40	Calculated Property
η	0.0005254	Pa×s	269.01	Calculated Property
η	0.0004055	Pa×s	288.62	Calculated Property
η	0.0003235	Pa×s	308.23	Calculated Property
η	0.0002651	Pa×s	327.85	Calculated Property
η	0.0002222	Pa×s	347.46	Calculated Property
η	0.0001898	Pa×s	367.07	Calculated Property

Similar Compounds

Find more compounds similar to Propane, 1,3-dimethoxy-.

Sources

• Cheméo Relay (1.0)
• 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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.