Chemical Properties of ETHYL N-(2-METHYLPHENYL)CARBAMATE

InChI

InChI=1S/C10H13NO2/c1-3-13-10(12)11-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H,11,12)

InChI Key

KXOFYXSXZGSQED-UHFFFAOYSA-N

Formula

C10H13NO2

SMILES

CCOC(=O)Nc1ccccc1C

Molecular Weight¹

179.22

Other Names

• Ethyl 2-methylphenylcarbamate
• Carbamic acid, 2-methylphenyl, ethyl ester

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• IE : Ionization energy (eV).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5936		Relay (1.0) Calculated Property
ΔfH°gas	-356.55	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.19	kJ/mol	Joback Calculated Property
ΔvapH°	78.92	kJ/mol	Relay (1.0) Calculated Property
IE	8.19	eV	Relay (1.0) Calculated Property
log10WS	-2.61		Relay (1.0) Calculated Property
logPoct/wat	2.563		Crippen Calculated Property
McVol	145.420	ml/mol	McGowan Calculated Property
Pc	3076.16	kPa	Joback Calculated Property
Inp	[1443.00; 1450.00]
Inp	1443.00		NIST
Inp	1443.00		NIST
Inp	1450.00		NIST
Inp	1445.00		NIST
Tboil	544.83	K	Relay (1.0) Calculated Property
Tc	763.39	K	Relay (1.0) Calculated Property
Tfus	321.78	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation 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

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[347.62; 416.30]	J/mol×K	[586.32; 800.02]
Cp,gas	347.62	J/mol×K	586.32	Joback Calculated Property
Cp,gas	360.93	J/mol×K	621.94	Joback Calculated Property
Cp,gas	373.47	J/mol×K	657.55	Joback Calculated Property
Cp,gas	385.26	J/mol×K	693.17	Joback Calculated Property
Cp,gas	396.32	J/mol×K	728.79	Joback Calculated Property
Cp,gas	406.66	J/mol×K	764.40	Joback Calculated Property
Cp,gas	416.30	J/mol×K	800.02	Joback Calculated Property

Similar Compounds

Find more compounds similar to ETHYL N-(2-METHYLPHENYL)CARBAMATE.

Sources

• Cheméo Relay (1.0)
• 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.