Chemical Properties of 1,3-Dioxolane, 2-(4-methoxyphenyl)-4-methyl- (CAS 6414-32-0)

InChI

InChI=1S/C11H14O3/c1-8-7-13-11(14-8)9-3-5-10(12-2)6-4-9/h3-6,8,11H,7H2,1-2H3

InChI Key

DTACWEXJFYOAKS-UHFFFAOYSA-N

Formula

C11H14O3

SMILES

COc1ccc(C2OCC(C)O2)cc1

Molecular Weight¹

194.23

CAS

6414-32-0

Other Names

• Anisaldehyde propylene glycol acetal
• Anis aldehydepropyleneglycol acetal 1
• 2-(4-methoxyphenyl)-4-methyl-1,3-dioxolane
• 1,3-Dioxolane, 2-(4-methoxyphenyl)-4-methyl, # 2

• 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°	-103.88	kJ/mol	Joback Calculated Property
ΔfH°gas	-401.39	kJ/mol	Joback Calculated Property
ΔfusH°	30.05	kJ/mol	Joback Calculated Property
ΔvapH°	54.40	kJ/mol	Joback Calculated Property
log10WS	-2.37		Crippen Calculated Property
logPoct/wat	2.129		Crippen Calculated Property
McVol	148.840	ml/mol	McGowan Calculated Property
Pc	2934.52	kPa	Joback Calculated Property
Inp	1512.00		NIST
I	[2234.00; 2234.00]
I	2234.00		NIST
I	2234.00		NIST
Tboil	569.67	K	Joback Calculated Property
Tc	798.91	K	Joback Calculated Property
Tfus	334.70	K	Joback Calculated Property
Vc	0.543	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[375.86; 464.06]	J/mol×K	[569.67; 798.91]
Cp,gas	375.86	J/mol×K	569.67	Joback Calculated Property
Cp,gas	393.15	J/mol×K	607.88	Joback Calculated Property
Cp,gas	409.37	J/mol×K	646.08	Joback Calculated Property
Cp,gas	424.56	J/mol×K	684.29	Joback Calculated Property
Cp,gas	438.72	J/mol×K	722.50	Joback Calculated Property
Cp,gas	451.88	J/mol×K	760.70	Joback Calculated Property
Cp,gas	464.06	J/mol×K	798.91	Joback Calculated Property
η	[0.0002770; 0.0019113]	Pa×s	[334.70; 569.67]
η	0.0019113	Pa×s	334.70	Joback Calculated Property
η	0.0011703	Pa×s	373.86	Joback Calculated Property
η	0.0007864	Pa×s	413.02	Joback Calculated Property
η	0.0005661	Pa×s	452.19	Joback Calculated Property
η	0.0004295	Pa×s	491.35	Joback Calculated Property
η	0.0003394	Pa×s	530.51	Joback Calculated Property
η	0.0002770	Pa×s	569.67	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,3-Dioxolane, 2-(4-methoxyphenyl)-4-methyl-.

Sources

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

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