Chemical Properties of 2,6-Piperidinedione, 3-ethyl-1-methyl-3-phenyl- (CAS 35622-13-0)

InChI

InChI=1S/C14H17NO2/c1-3-14(11-7-5-4-6-8-11)10-9-12(16)15(2)13(14)17/h4-8H,3,9-10H2,1-2H3

InChI Key

JHJUZGCNVJFGMC-UHFFFAOYSA-N

Formula

C14H17NO2

SMILES

CCC1(c2ccccc2)CCC(=O)N(C)C1=O

Molecular Weight¹

231.29

CAS

35622-13-0

Other Names

• Glutarimide, 2-ethyl-N-methyl-2-phenyl-
• Gluthethimide methyl derivative
• Glutethimide permethylated
• Glutethimide Me

• ω : Acentric Factor.
• 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	0.5062		Relay (1.0) Calculated Property
ΔfG°	17.75	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-268.39	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	82.70	kJ/mol	Relay (1.0) Calculated Property
IE	8.77	eV	Relay (1.0) Calculated Property
log10WS	-2.10		Relay (1.0) Calculated Property
logPoct/wat	2.113		Crippen Calculated Property
McVol	186.620	ml/mol	McGowan Calculated Property
Pc	2233.72	kPa	Relay (1.0-beta) Calculated Property
Inp	[1797.00; 1897.00]
Inp	1897.00		NIST
Inp	1797.00		NIST
Tboil	605.19	K	Relay (1.0) Calculated Property
Tc	852.62	K	Relay (1.0) Calculated Property
Tfus	374.16	K	Relay (1.0) Calculated Property
Vc	0.651	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 2,6-Piperidinedione, 3-ethyl-1-methyl-3-phenyl-.

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
• McGowan Method
• NIST Webbook

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