Chemical Properties of 3-Nitro-2-butanol (CAS 6270-16-2)

InChI

InChI=1S/C4H9NO3/c1-3(4(2)6)5(7)8/h3-4,6H,1-2H3

InChI Key

OJVOGABFNZDOOZ-UHFFFAOYSA-N

Formula

C4H9NO3

SMILES

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

Molecular Weight¹

119.12

CAS

6270-16-2

Other Names

• 2-Butanol, 3-nitro-
• 2-Nitrobutan-3-ol
• 3-nitrobutan-2-ol

• 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	[210.96; 254.74]	J/mol×K	[534.06; 737.07]
Cp,gas	210.96	J/mol×K	534.06	Joback Calculated Property
Cp,gas	219.34	J/mol×K	567.89	Joback Calculated Property
Cp,gas	227.26	J/mol×K	601.73	Joback Calculated Property
Cp,gas	234.75	J/mol×K	635.56	Joback Calculated Property
Cp,gas	241.82	J/mol×K	669.40	Joback Calculated Property
Cp,gas	248.47	J/mol×K	703.23	Joback Calculated Property
Cp,gas	254.74	J/mol×K	737.07	Joback Calculated Property

Similar Compounds

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

Sources

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

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