Chemical Properties of 1,2,4-Butanetriol (CAS 3068-00-6)

InChI

InChI=1S/C4H10O3/c5-2-1-4(7)3-6/h4-7H,1-3H2

InChI Key

ARXKVVRQIIOZGF-UHFFFAOYSA-N

Formula

C4H10O3

SMILES

OCCC(O)CO

Molecular Weight¹

106.12

CAS

3068-00-6

Other Names

• 1,2,4-Butantriol
• 1,2,4-trihydroxybutane
• 1,3,4-butanetriol
• 2-Deoxyerythritol
• Butane-1,2,4-triol
• HOCH2CH(OH)CH2CH2OH
• Triol 124

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• 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).
• 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_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

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[211.49; 243.37]	J/mol×K	[567.02; 725.28]
Cp,gas	211.49	J/mol×K	567.02	Joback Calculated Property
Cp,gas	217.38	J/mol×K	593.40	Joback Calculated Property
Cp,gas	223.03	J/mol×K	619.77	Joback Calculated Property
Cp,gas	228.44	J/mol×K	646.15	Joback Calculated Property
Cp,gas	233.64	J/mol×K	672.52	Joback Calculated Property
Cp,gas	238.61	J/mol×K	698.90	Joback Calculated Property
Cp,gas	243.37	J/mol×K	725.28	Joback Calculated Property
η	[0.0000216; 0.1910150]	Pa×s	[302.30; 567.02]
η	0.1910150	Pa×s	302.30	Joback Calculated Property
η	0.0160153	Pa×s	346.42	Joback Calculated Property
η	0.0023509	Pa×s	390.54	Joback Calculated Property
η	0.0005095	Pa×s	434.66	Joback Calculated Property
η	0.0001463	Pa×s	478.78	Joback Calculated Property
η	0.0000519	Pa×s	522.90	Joback Calculated Property
η	0.0000216	Pa×s	567.02	Joback Calculated Property

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboilr	[440.50; 463.70]	K	[1.50; 2.40]
Tboilr	440.50 ± 0.50	K	1.50	NIST
Tboilr	463.70	K	2.40	NIST

Similar Compounds

Find more compounds similar to 1,2,4-Butanetriol.

Mixtures

• 1,2,4-Butanetriol + Water

Sources

• Crippen Method
• Crippen Method
• Isopiestic determination of osmotic and activity coefficients of aqueous solutions of aliphatic polyols at 298.15K
• Enthalpies of dilution of aqueous solutions of n-butanol, butanediols, 1,2,4-butanetriol, and 1,2,3,4-butanetetrol at 298.15K
• Joback Method
• McGowan Method
• NIST Webbook

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