Chemical Properties of 3-CHLORO-2,2-DIMETHYL-1-PROPANOL

InChI

InChI=1S/C5H11ClO/c1-5(2,3-6)4-7/h7H,3-4H2,1-2H3

InChI Key

CAZPRAORHCOIHC-UHFFFAOYSA-N

Formula

C5H11ClO

SMILES

CC(C)(CO)CCl

Molecular Weight¹

122.59

Other Names

• 1-Propanol, 3-chloro-2,2-dimethyl-
• 3-chloro-2,2-dimethylpropan-1-ol

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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).
• P_vap : Vapor pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[136.00; 305.69]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-7.94800e+00
Coefficient B			6.45440e-01
Coefficient C			-4.70800e-04
Coefficient D			1.39000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	136.00	J/mol×K	273.00	Calculated Property
Cp,gas	167.62	J/mol×K	353.78	Calculated Property
Cp,gas	195.03	J/mol×K	434.56	Calculated Property
Cp,gas	218.66	J/mol×K	515.33	Calculated Property
Cp,gas	238.95	J/mol×K	596.11	Calculated Property
Cp,gas	256.34	J/mol×K	676.89	Calculated Property
Cp,gas	271.27	J/mol×K	757.67	Calculated Property
Cp,gas	284.18	J/mol×K	838.44	Calculated Property
Cp,gas	295.51	J/mol×K	919.22	Calculated Property
Cp,gas	305.69	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0728117; 0.0003113]	Pa×s	[239.27; 433.54]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.47931e+01
Coefficient B			2.91269e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			239.27
Temperature range, max.			433.54
η	0.0728117	Pa×s	239.27	Calculated Property
η	0.0265910	Pa×s	260.86	Calculated Property
η	0.0113275	Pa×s	282.44	Calculated Property
η	0.0054470	Pa×s	304.03	Calculated Property
η	0.0028863	Pa×s	325.61	Calculated Property
η	0.0016551	Pa×s	347.20	Calculated Property
η	0.0010129	Pa×s	368.78	Calculated Property
η	0.0006545	Pa×s	390.37	Calculated Property
η	0.0004427	Pa×s	411.95	Calculated Property
η	0.0003113	Pa×s	433.54	Calculated Property

Similar Compounds

Find more compounds similar to 3-CHLORO-2,2-DIMETHYL-1-PROPANOL.

Mixtures

• Cyclohexane, methyl- + 3-CHLORO-2,2-DIMETHYL-1-PROPANOL

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Isobaric Vapor-Liquid Equilibrium for Two Binary Systems of 3,3-Dimethyloxetane + Methyl Cyclohexane and 3-Chloro-2,2-dimethyl-1-propanol + Methyl Cyclohexane at 101.3 kPa
• Joback Method
• McGowan Method
• NIST Webbook

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