Chemical Properties of Tridecane-2,4-dione (CAS 25276-80-6)

InChI

InChI=1S/C13H24O2/c1-3-4-5-6-7-8-9-10-13(15)11-12(2)14/h3-11H2,1-2H3

InChI Key

QAXKYAIESKANJL-UHFFFAOYSA-N

Formula

C13H24O2

SMILES

CCCCCCCCCC(=O)CC(C)=O

Molecular Weight¹

212.33

CAS

25276-80-6

Other Names

• 2,4-Tridecadione
• 2,4-Tridecanedione

• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ω	0.6899		Relay (1.0) Calculated Property
ΔfG°	-199.26	kJ/mol	Joback Calculated Property
ΔfH°gas	-563.74	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	32.62	kJ/mol	Joback Calculated Property
ΔvapH°	66.64	kJ/mol	Relay (1.0) Calculated Property
IE	8.96	eV	Relay (1.0) Calculated Property
log10WS	-4.05		Relay (1.0) Calculated Property
logPoct/wat	3.675		Crippen Calculated Property
McVol	197.170	ml/mol	McGowan Calculated Property
Pc	1826.28	kPa	Joback Calculated Property
Inp	[1560.00; 1560.00]
Inp	1560.00		NIST
Inp	1560.00		NIST
Tboil	544.47	K	Relay (1.0) Calculated Property
Tc	735.86	K	Relay (1.0) Calculated Property
Tfus	315.38	K	Relay (1.0) Calculated Property
Vc	0.743	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[512.61; 595.67]	J/mol×K	[604.78; 781.92]
Cp,gas	512.61	J/mol×K	604.78	Joback Calculated Property
Cp,gas	528.16	J/mol×K	634.30	Joback Calculated Property
Cp,gas	543.01	J/mol×K	663.83	Joback Calculated Property
Cp,gas	557.16	J/mol×K	693.35	Joback Calculated Property
Cp,gas	570.64	J/mol×K	722.87	Joback Calculated Property
Cp,gas	583.47	J/mol×K	752.39	Joback Calculated Property
Cp,gas	595.67	J/mol×K	781.92	Joback Calculated Property
η	[0.0002201; 0.0032060]	Pa×s	[336.13; 604.78]
η	0.0032060	Pa×s	336.13	Joback Calculated Property
η	0.0015780	Pa×s	380.90	Joback Calculated Property
η	0.0009016	Pa×s	425.68	Joback Calculated Property
η	0.0005731	Pa×s	470.45	Joback Calculated Property
η	0.0003941	Pa×s	515.23	Joback Calculated Property
η	0.0002878	Pa×s	560.00	Joback Calculated Property
η	0.0002201	Pa×s	604.78	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tridecane-2,4-dione.

Sources

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

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