Chemical Properties of 1-(4-Methoxyphenyl)prop-2-en-1-one (CAS 7448-86-4)

InChI

InChI=1S/C10H10O2/c1-3-10(11)8-4-6-9(12-2)7-5-8/h3-7H,1H2,2H3

InChI Key

YMESWDPSFKMFND-UHFFFAOYSA-N

Formula

C10H10O2

SMILES

C=CC(=O)c1ccc(OC)cc1

Molecular Weight¹

162.19

CAS

7448-86-4

• 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.
• 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°	-9.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-144.04	kJ/mol	Joback Calculated Property
ΔfusH°	16.82	kJ/mol	Joback Calculated Property
ΔvapH°	49.28	kJ/mol	Joback Calculated Property
log10WS	-2.52		Crippen Calculated Property
logPoct/wat	2.064		Crippen Calculated Property
McVol	131.140	ml/mol	McGowan Calculated Property
Pc	3177.55	kPa	Joback Calculated Property
Inp	[1452.70; 1452.70]
Inp	1452.70		NIST
Inp	1452.70		NIST
Tboil	532.83	K	Joback Calculated Property
Tc	751.29	K	Joback Calculated Property
Tfus	311.80	K	Joback Calculated Property
Vc	0.492	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[281.47; 346.30]	J/mol×K	[532.83; 751.29]
Cp,gas	281.47	J/mol×K	532.83	Joback Calculated Property
Cp,gas	294.02	J/mol×K	569.24	Joback Calculated Property
Cp,gas	305.84	J/mol×K	605.65	Joback Calculated Property
Cp,gas	316.97	J/mol×K	642.06	Joback Calculated Property
Cp,gas	327.40	J/mol×K	678.47	Joback Calculated Property
Cp,gas	337.18	J/mol×K	714.88	Joback Calculated Property
Cp,gas	346.30	J/mol×K	751.29	Joback Calculated Property
η	[0.0002143; 0.0016570]	Pa×s	[311.80; 532.83]
η	0.0016570	Pa×s	311.80	Joback Calculated Property
η	0.0009841	Pa×s	348.64	Joback Calculated Property
η	0.0006457	Pa×s	385.48	Joback Calculated Property
η	0.0004560	Pa×s	422.31	Joback Calculated Property
η	0.0003405	Pa×s	459.15	Joback Calculated Property
η	0.0002655	Pa×s	495.99	Joback Calculated Property
η	0.0002143	Pa×s	532.83	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-(4-Methoxyphenyl)prop-2-en-1-one.

Sources

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

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