Chemical Properties of 2-Propanol, 1-(2-methoxypropoxy)- (CAS 13429-07-7)

InChI

InChI=1S/C7H16O3/c1-6(8)4-10-5-7(2)9-3/h6-8H,4-5H2,1-3H3

InChI Key

FOLPKOWCPVGUCA-UHFFFAOYSA-N

Formula

C7H16O3

SMILES

COC(C)COCC(C)O

Molecular Weight¹

148.20

CAS

13429-07-7

Other Names

• 1-(2-Methoxypropoxy)-2-propanol
• 1-(2-Methoxypropoxy)-propan-2-ol
• 1-(2-methoxypropyl)-2-propanol
• 34590-94-8
• Dipropylene glycol monomethyl ether

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• T_flash,cc : Flash Point (Closed Cup Method) (K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• NFPA Fire : NFPA Fire Rating.
• NFPA Health : NFPA Health Rating.
• NFPA Safety : NFPA Safety Rating.
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• n₀ : Refractive Index.
• I_p : Polar retention indices.
• γ : Surface Tension (N/m).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
Tflash,cc	358.15	K	NCMS SOLV-DB
ΔfusH°	13.30	kJ/mol	Joback Calculated Property
ΔvapH°	63.03	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	-0.200		NCMS SOLV-DB
McVol	127.100	ml/mol	McGowan Calculated Property
NFPA Fire	2		NCMS SOLV-DB
NFPA Health	0		NCMS SOLV-DB
NFPA Safety	0		NCMS SOLV-DB
Pc	3032.27	kPa	Joback Calculated Property
Ip	[1509.00; 1541.00]
Ip	1532.00		NIST
Ip	1509.00		NIST
Ip	1541.00		NIST
Tboil	461.45	K	NCMS SOLV-DB
Tc	635.07	K	Relay (1.0) Calculated Property
Tfus	193.15	K	NCMS SOLV-DB

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[196.66; 437.21]	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			4.94520e+01
Coefficient B			5.88260e-01
Coefficient C			-1.71800e-04
Coefficient D			-2.87000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	196.66	J/mol×K	273.00	Calculated Property
Cp,gas	234.79	J/mol×K	353.78	Calculated Property
Cp,gas	270.29	J/mol×K	434.56	Calculated Property
Cp,gas	303.05	J/mol×K	515.33	Calculated Property
Cp,gas	332.99	J/mol×K	596.11	Calculated Property
Cp,gas	360.02	J/mol×K	676.89	Calculated Property
Cp,gas	384.05	J/mol×K	757.67	Calculated Property
Cp,gas	404.99	J/mol×K	838.44	Calculated Property
Cp,gas	422.74	J/mol×K	919.22	Calculated Property
Cp,gas	437.21	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2-Propanol, 1-(2-methoxypropoxy)-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• NCMS SOLV-DB

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