Chemical Properties of 2-Nitro-3-methyl-1-butanol (CAS 77392-54-2)

InChI

InChI=1S/C5H11NO3/c1-4(2)5(3-7)6(8)9/h4-5,7H,3H2,1-2H3

InChI Key

DMIRKUOHEBAINR-UHFFFAOYSA-N

Formula

C5H11NO3

SMILES

CC(C)C(CO)[N+](=O)[O-]

Molecular Weight¹

133.15

CAS

77392-54-2

• 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	[253.86; 303.25]	J/mol×K	[556.94; 757.03]
Cp,gas	253.86	J/mol×K	556.94	Joback Calculated Property
Cp,gas	263.29	J/mol×K	590.29	Joback Calculated Property
Cp,gas	272.23	J/mol×K	623.64	Joback Calculated Property
Cp,gas	280.67	J/mol×K	656.98	Joback Calculated Property
Cp,gas	288.65	J/mol×K	690.33	Joback Calculated Property
Cp,gas	296.16	J/mol×K	723.68	Joback Calculated Property
Cp,gas	303.25	J/mol×K	757.03	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Nitro-3-methyl-1-butanol.

Sources

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

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