Chemical Properties of Benzene, 1,2-dimethoxy-4-(1-propenyl)- (CAS 93-16-3)

InChI

InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3

InChI Key

NNWHUJCUHAELCL-UHFFFAOYSA-N

Formula

C11H14O2

SMILES

CC=Cc1ccc(OC)c(OC)c1

Molecular Weight¹

178.23

CAS

93-16-3

Other Names

• Benzene, 1,2-dimethoxy-4-propenyl-
• Isoeugenol methyl ether
• Isoeugenyl methyl ether
• Isohomogenol
• Methylisoeugenol
• O-Methylisoeugenol
• 1-(3,4-Dimethoxyphenyl)-1-propene
• 1-Veratryl-1-propene
• 3,4-Dimethoxypropenylbenzene
• 4-Propenyl-1,2-dimethoxybenzene
• 4-Propenylveratrole
• 1-Propene, 1-(3,4-dimethoxyphenyl)-
• 1,3,4-Isoeugenol methyl ether
• Benzene, 4-(1-propenyl)-1,2-dimethoxy
• Isomethyleugenol
• Benzene, 1,2-dimethoxy-4-(1-propen-1-yl)-
• NSC 46111
• Veratrole, 4-propenyl-
• 1,2-Dimethoxy-4-(1-propenyl)-benzene
• 4-prop-1-enylveratrole

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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°	5.11	kJ/mol	Joback Calculated Property
ΔfH°gas	-204.00	kJ/mol	Joback Calculated Property
ΔfusH°	20.09	kJ/mol	Joback Calculated Property
ΔvapH°	48.46	kJ/mol	Joback Calculated Property
log10WS	-2.95		Crippen Calculated Property
logPoct/wat	2.737		Crippen Calculated Property
McVol	149.530	ml/mol	McGowan Calculated Property
Pc	2616.41	kPa	Joback Calculated Property
Inp	[1455.00; 1520.00]
Inp	1495.00		NIST
Inp	1508.00		NIST
Inp	Outlier 1520.00		NIST
Inp	1455.00		NIST
Inp	1461.00		NIST
Inp	1480.00		NIST
Inp	1480.00		NIST
Inp	1492.00		NIST
Inp	1492.00		NIST
Inp	1492.00		NIST
Inp	1504.00		NIST
Inp	1491.00		NIST
Inp	1468.00		NIST
Inp	1468.00		NIST
Inp	1492.00		NIST
Inp	1466.00		NIST
Inp	1462.00		NIST
Inp	1480.00		NIST
Inp	1492.00		NIST
Inp	1468.00		NIST
I	[2126.00; 2196.00]
I	2189.00		NIST
I	2196.00		NIST
I	Outlier 2126.00		NIST
I	2185.00		NIST
I	2176.00		NIST
I	2194.00		NIST
Tboil	536.20	K	NIST
Tc	746.85	K	Joback Calculated Property
Tfus	304.57	K	Joback Calculated Property
Vc	0.559	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[333.08; 408.27]	J/mol×K	[536.72; 746.85]
Cp,gas	333.08	J/mol×K	536.72	Joback Calculated Property
Cp,gas	347.28	J/mol×K	571.74	Joback Calculated Property
Cp,gas	360.80	J/mol×K	606.76	Joback Calculated Property
Cp,gas	373.65	J/mol×K	641.78	Joback Calculated Property
Cp,gas	385.84	J/mol×K	676.80	Joback Calculated Property
Cp,gas	397.38	J/mol×K	711.82	Joback Calculated Property
Cp,gas	408.27	J/mol×K	746.85	Joback Calculated Property
η	[0.0001220; 0.0010229]	Pa×s	[304.57; 536.72]
η	0.0010229	Pa×s	304.57	Joback Calculated Property
η	0.0005877	Pa×s	343.26	Joback Calculated Property
η	0.0003778	Pa×s	381.95	Joback Calculated Property
η	0.0002634	Pa×s	420.64	Joback Calculated Property
η	0.0001952	Pa×s	459.34	Joback Calculated Property
η	0.0001515	Pa×s	498.03	Joback Calculated Property
η	0.0001220	Pa×s	536.72	Joback Calculated Property
ΔvapH	61.90	kJ/mol	439.50	NIST

Similar Compounds

Find more compounds similar to Benzene, 1,2-dimethoxy-4-(1-propenyl)-.

Sources

• 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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.