Chemical Properties of Platambin-1,6-dione (CAS 58556-83-5)

InChI

InChI=1S/C15H22O2/c1-9(2)11-7-8-15(4)12(16)6-5-10(3)13(15)14(11)17/h9,11,13H,3,5-8H2,1-2,4H3

InChI Key

GNOBKKNJWOFLHO-UHFFFAOYSA-N

Formula

C15H22O2

SMILES

C=C1CCC(=O)C2(C)CCC(C(C)C)C(=O)C12

Molecular Weight¹

234.33

CAS

58556-83-5

• 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).
• 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
ΔfG°	-59.22	kJ/mol	Joback Calculated Property
ΔfH°gas	-433.51	kJ/mol	Joback Calculated Property
ΔfusH°	11.59	kJ/mol	Joback Calculated Property
ΔvapH°	56.30	kJ/mol	Joback Calculated Property
log10WS	-3.34		Crippen Calculated Property
logPoct/wat	3.163		Crippen Calculated Property
McVol	199.330	ml/mol	McGowan Calculated Property
Pc	2086.93	kPa	Joback Calculated Property
Inp	[1923.00; 1923.00]
Inp	1923.00		NIST
Inp	1923.00		NIST
Tboil	703.09	K	Joback Calculated Property
Tc	947.07	K	Joback Calculated Property
Tfus	435.39	K	Joback Calculated Property
Vc	0.747	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[601.39; 719.15]	J/mol×K	[703.09; 947.07]
Cp,gas	601.39	J/mol×K	703.09	Joback Calculated Property
Cp,gas	623.69	J/mol×K	743.75	Joback Calculated Property
Cp,gas	644.78	J/mol×K	784.42	Joback Calculated Property
Cp,gas	664.77	J/mol×K	825.08	Joback Calculated Property
Cp,gas	683.75	J/mol×K	865.74	Joback Calculated Property
Cp,gas	701.84	J/mol×K	906.40	Joback Calculated Property
Cp,gas	719.15	J/mol×K	947.07	Joback Calculated Property

Similar Compounds

Find more compounds similar to Platambin-1,6-dione.

Sources

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

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