Chemical Properties of Photocytral A

InChI

InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(9)6-11/h6,8-10H,1,4-5H2,2-3H3/t8-,9+,10-/m1/s1

InChI Key

JCDLXWAYWSJVTP-KXUCPTDWSA-N

Formula

C10H16O

SMILES

C=C(C)C1CCC(C)C1C=O

Molecular Weight¹

152.23

• 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	0.3339		Relay (... Calculated Property
ΔfG°	34.22	kJ/mol	Joback Calculated Property
ΔfH°gas	-176.93	kJ/mol	Relay (... Calculated Property
ΔfusH°	17.43	kJ/mol	Joback Calculated Property
ΔvapH°	58.42	kJ/mol	Relay (... Calculated Property
IE	9.08	eV	Relay (... Calculated Property
log10WS	-2.91		Relay (... Calculated Property
logPoct/wat	2.424		Crippen Calculated Property
McVol	138.170	ml/mol	McGowan Calculated Property
Pc	2648.83	kPa	Joback Calculated Property
Inp	[1118.00; 1118.00]
Inp	1118.00		NIST
Inp	1118.00		NIST
Tboil	471.70	K	Relay (... Calculated Property
Tc	683.28	K	Relay (... Calculated Property
Tfus	247.42	K	Relay (... Calculated Property
Vc	0.461	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[311.37; 402.93]	J/mol×K	[479.36; 681.52]
Cp,gas	311.37	J/mol×K	479.36	Joback Calculated Property
Cp,gas	328.76	J/mol×K	513.05	Joback Calculated Property
Cp,gas	345.26	J/mol×K	546.75	Joback Calculated Property
Cp,gas	360.90	J/mol×K	580.44	Joback Calculated Property
Cp,gas	375.71	J/mol×K	614.13	Joback Calculated Property
Cp,gas	389.72	J/mol×K	647.82	Joback Calculated Property
Cp,gas	402.93	J/mol×K	681.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to Photocytral A.

Sources

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

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