Chemical Properties of 1,4-Dioxyl radical (CAS 4598-47-4)

InChI

InChI=1S/C4H7O2/c1-2-6-4-3-5-1/h1H,2-4H2

InChI Key

XTKIUJCPLLOSMW-UHFFFAOYSA-N

Formula

C4H7O2

SMILES

[CH]1COCCO1

Molecular Weight¹

87.10

CAS

4598-47-4

• ω : Acentric Factor.
• 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).
• 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).
• 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	[113.67; 169.01]	J/mol×K	[363.67; 568.40]
Cp,gas	113.67	J/mol×K	363.67	Joback Calculated Property
Cp,gas	124.48	J/mol×K	397.79	Joback Calculated Property
Cp,gas	134.61	J/mol×K	431.91	Joback Calculated Property
Cp,gas	144.10	J/mol×K	466.03	Joback Calculated Property
Cp,gas	152.97	J/mol×K	500.15	Joback Calculated Property
Cp,gas	161.26	J/mol×K	534.28	Joback Calculated Property
Cp,gas	169.01	J/mol×K	568.40	Joback Calculated Property
η	[0.0005240; 0.0025959]	Pa×s	[211.73; 363.67]
η	0.0025959	Pa×s	211.73	Joback Calculated Property
η	0.0017242	Pa×s	237.05	Joback Calculated Property
η	0.0012394	Pa×s	262.38	Joback Calculated Property
η	0.0009442	Pa×s	287.70	Joback Calculated Property
η	0.0007517	Pa×s	313.02	Joback Calculated Property
η	0.0006192	Pa×s	338.35	Joback Calculated Property
η	0.0005240	Pa×s	363.67	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,4-Dioxyl radical.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.