Chemical Properties of 4-Chloro-a-(dimethylamino)-o-cresol (CAS 54828-00-1)

InChI

InChI=1S/C9H12ClNO/c1-11(2)6-7-5-8(10)3-4-9(7)12/h3-5,12H,6H2,1-2H3

InChI Key

WPEGHIRPYPPYDO-UHFFFAOYSA-N

Formula

C9H12ClNO

SMILES

CN(C)Cc1cc(Cl)ccc1O

Molecular Weight¹

185.65

CAS

54828-00-1

• 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_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[325.70; 388.08]	J/mol×K	[567.47; 791.85]
Cp,gas	325.70	J/mol×K	567.47	Joback Calculated Property
Cp,gas	338.04	J/mol×K	604.87	Joback Calculated Property
Cp,gas	349.48	J/mol×K	642.26	Joback Calculated Property
Cp,gas	360.12	J/mol×K	679.66	Joback Calculated Property
Cp,gas	370.04	J/mol×K	717.06	Joback Calculated Property
Cp,gas	379.33	J/mol×K	754.46	Joback Calculated Property
Cp,gas	388.08	J/mol×K	791.85	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Chloro-a-(dimethylamino)-o-cresol.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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