Chemical Properties of Hydroxyphenamate (CAS 50-19-1)

InChI

InChI=1S/C11H15NO3/c1-2-11(14,8-15-10(12)13)9-6-4-3-5-7-9/h3-7,14H,2,8H2,1H3,(H2,12,13)

InChI Key

WAFIYOULDIWAKR-UHFFFAOYSA-N

Formula

C11H15NO3

SMILES

CCC(O)(COC(=N)O)c1ccccc1

Molecular Weight¹

209.24

CAS

50-19-1

Other Names

• 1,2-Butanediol, 2-phenyl-, 1-carbamate
• «beta»-Ethyl-«beta»-hydroxyphenethyl carbamate
• Al-0361
• Listica
• Oxyfenamate
• Oxyphenamate
• P 301
• 2-Hydroxy-2-Phenylbutyl carbamate
• Carbamic acid, «beta»-ethyl-«beta»-hydroxyphenethyl ester
• Hidroxifenamato
• Phenylbutamate
• Tensifen
• 2-Phenyl-1,2-butanediol 1-carbamate
• «beta»-Ethyl-«beta»-hydroxyphenethyl carbamic acid ester
• NSC-108034
• Oxifenamate

• ω : Acentric Factor.
• 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_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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.9220		Relay (1.0) Calculated Property
ΔfG°	-18.05	kJ/mol	Joback Calculated Property
ΔfH°gas	-534.84	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	107.94	kJ/mol	Relay (1.0) Calculated Property
IE	8.97	eV	Relay (1.0) Calculated Property
log10WS	-0.93		Relay (1.0) Calculated Property
logPoct/wat	1.794		Crippen Calculated Property
McVol	165.380	ml/mol	McGowan Calculated Property
Pc	2976.62	kPa	Relay (1.0-beta) Calculated Property
Inp	[1724.00; 1724.00]
Inp	1724.00		NIST
Inp	1724.00		NIST
Tboil	574.01	K	Relay (1.0) Calculated Property
Tc	828.48	K	Relay (1.0) Calculated Property
Tfus	379.66	K	Relay (1.0) Calculated Property
Vc	0.564	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[61.88; 478.17]	J/mol×K	[100.12; 765.65]
Cp,gas	61.88	J/mol×K	100.12	Joback Calculated Property
Cp,gas	61.88	J/mol×K	100.12	Joback Calculated Property
Cp,gas	61.88	J/mol×K	100.12	Joback Calculated Property
Cp,gas	61.88	J/mol×K	100.12	Joback Calculated Property
Cp,gas	61.88	J/mol×K	100.12	Joback Calculated Property
Cp,gas	61.88	J/mol×K	100.12	Joback Calculated Property
Cp,gas	478.17	J/mol×K	765.65	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hydroxyphenamate.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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