Chemical Properties of 2(1H)-Pyridone, 6-methyl- (CAS 3279-76-3)

InChI

InChI=1S/C6H7NO/c1-5-3-2-4-6(8)7-5/h2-4H,1H3,(H,7,8)

InChI Key

JEAVIRYCMBDJIU-UHFFFAOYSA-N

Formula

C6H7NO

SMILES

Cc1cccc(=O)[nH]1

Molecular Weight¹

109.13

CAS

3279-76-3

Other Names

• 6-Methyl-2-pyridinol
• 2(1H)-Pyridinone, 6-methyl-
• 2-Methyl-6-pyridone
• 6-Methyl-2-hydroxypyridine
• 6-Methyl-2-pyridinone
• 6-Methyl-2-pyridone
• 2-Hydroxy-6-methylpyridine
• 6-Methyl-2-pyridyl alcohol
• 6-Methyl-2(1H)-pyridone
• 2-Methyl-6-hydroxypyridine
• 6-Methyl-2(1H)-pyridinone
• 6-methylpyridin-2-ol

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_subH° : Enthalpy of sublimation 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).
• 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	0.4264		Relay (1.0) Calculated Property
ΔcH°solid	-3149.20 ± 1.90	kJ/mol	NIST
ΔfG°	1.72	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-120.30 ± 2.50	kJ/mol	NIST
ΔfH°solid	-212.30 ± 2.10	kJ/mol	NIST
ΔsubH°	[92.00; 92.00]	kJ/mol
ΔsubH°	92.00 ± 1.30	kJ/mol	NIST
ΔsubH°	92.00 ± 1.30	kJ/mol	NIST
ΔvapH°	83.15	kJ/mol	Relay (1.0) Calculated Property
IE	8.19 ± 0.03	eV	NIST
log10WS	0.11		Relay (1.0) Calculated Property
logPoct/wat	0.201		Crippen Calculated Property
McVol	87.490	ml/mol	McGowan Calculated Property
Pc	5082.74	kPa	Relay (1.0-beta) Calculated Property
Tboil	522.60	K	Relay (1.0) Calculated Property
Tc	712.78	K	Relay (1.0) Calculated Property
Tfus	340.13	K	Relay (1.0) Calculated Property
Vc	0.304	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 2(1H)-Pyridone, 6-methyl-.

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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