Chemical Properties of (+)-Plagio-4,7-peroxide

InChI

InChI=1S/C15H26O2/c1-10(2)13-15-8-5-11(3)12(15)6-7-14(4,9-15)17-16-13/h10-13H,5-9H2,1-4H3/t11-,12+,13?,14+,15+/m0/s1

InChI Key

CVLOTRRVFUWEST-KEKZVJSRSA-N

Formula

C15H26O2

SMILES

CC(C)C1OOC2(C)CCC3C(C)CCC31C2

Molecular Weight¹

238.37

• ω : Acentric Factor.
• 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).
• 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	0.4336		Relay (1.0) Calculated Property
ΔfG°	20.29	kJ/mol	Joback Calculated Property
ΔfH°gas	-271.63	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	24.69	kJ/mol	Joback Calculated Property
ΔvapH°	68.10	kJ/mol	Relay (1.0) Calculated Property
IE	8.38	eV	Relay (1.0) Calculated Property
log10WS	-4.68		Relay (1.0) Calculated Property
logPoct/wat	3.948		Crippen Calculated Property
McVol	201.370	ml/mol	McGowan Calculated Property
Pc	2106.13	kPa	Joback Calculated Property
Inp	[1420.00; 1420.00]
Inp	1420.00		NIST
Inp	1420.00		NIST
Inp	1420.00		NIST
Tboil	547.24	K	Relay (1.0) Calculated Property
Tc	783.24	K	Relay (1.0) Calculated Property
Tfus	329.77	K	Relay (1.0) Calculated Property
Vc	0.745	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[597.39; 724.09]	J/mol×K	[620.23; 849.95]
Cp,gas	597.39	J/mol×K	620.23	Joback Calculated Property
Cp,gas	620.95	J/mol×K	658.52	Joback Calculated Property
Cp,gas	643.13	J/mol×K	696.80	Joback Calculated Property
Cp,gas	664.23	J/mol×K	735.09	Joback Calculated Property
Cp,gas	684.56	J/mol×K	773.38	Joback Calculated Property
Cp,gas	704.41	J/mol×K	811.67	Joback Calculated Property
Cp,gas	724.09	J/mol×K	849.95	Joback Calculated Property

Similar Compounds

Find more compounds similar to (+)-Plagio-4,7-peroxide.

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.