Chemical Properties of 1,3-Dioxolane, 2-methyl-2-phenyl- (CAS 3674-77-9)

InChI

InChI=1S/C10H12O2/c1-10(11-7-8-12-10)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3

InChI Key

GAOQAPRPYXWTFK-UHFFFAOYSA-N

Formula

C10H12O2

SMILES

CC1(c2ccccc2)OCCO1

Molecular Weight¹

164.20

CAS

3674-77-9

Other Names

• Acetophenone ethylene ketal
• 2-Methyl-2-phenyl-1,3-dioxolane

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_subH° : Enthalpy of sublimation at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (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).
• 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
ΔcH°solid	-5306.30 ± 2.00	kJ/mol	NIST
ΔfG°	4.55	kJ/mol	Joback Calculated Property
ΔfH°gas	-261.90 ± 2.20	kJ/mol	NIST
ΔfH°solid	-343.80 ± 2.10	kJ/mol	NIST
ΔfusH°	19.29	kJ/mol	Joback Calculated Property
ΔsubH°	[81.88; 81.90]	kJ/mol
ΔsubH°	81.88 ± 0.50	kJ/mol	NIST
ΔsubH°	81.90	kJ/mol	NIST
ΔvapH°	48.26	kJ/mol	Joback Calculated Property
log10WS	-1.84		Crippen Calculated Property
logPoct/wat	1.906		Crippen Calculated Property
McVol	128.880	ml/mol	McGowan Calculated Property
Pc	3718.02	kPa	Joback Calculated Property
Tboil	524.30	K	Joback Calculated Property
Tc	770.55	K	Joback Calculated Property
Tfus	316.82	K	Joback Calculated Property
Vc	0.469	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[301.71; 384.69]	J/mol×K	[524.30; 770.55]
Cp,gas	301.71	J/mol×K	524.30	Joback Calculated Property
Cp,gas	318.41	J/mol×K	565.34	Joback Calculated Property
Cp,gas	333.71	J/mol×K	606.38	Joback Calculated Property
Cp,gas	347.79	J/mol×K	647.42	Joback Calculated Property
Cp,gas	360.86	J/mol×K	688.47	Joback Calculated Property
Cp,gas	373.10	J/mol×K	729.51	Joback Calculated Property
Cp,gas	384.69	J/mol×K	770.55	Joback Calculated Property
ΔsubH	81.90 ± 0.50	kJ/mol	308.50	NIST

Similar Compounds

Find more compounds similar to 1,3-Dioxolane, 2-methyl-2-phenyl-.

Sources

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

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