Chemical Properties of Benzo[e]phenanthro[1,10,9,8-opqra]perylene (CAS 120835-99-6)

InChI

InChI=1S/C32H16/c1-2-10-21-17(6-1)15-26-24-13-4-8-19-14-18-7-3-11-22-23-12-5-9-20-16-25(21)30(26)32(29(20)23)31(27(18)22)28(19)24/h1-16H

InChI Key

QVKVJKTYXFWTED-UHFFFAOYSA-N

Formula

C32H16

SMILES

c1ccc2c(c1)cc1c3cccc4cc5cccc6c7cccc8cc2c1c(c87)c(c56)c43

Molecular Weight¹

400.47

CAS

120835-99-6

• 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).
• 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	[953.39; 1209.85]	J/mol×K	[1121.84; 1399.15]
Cp,gas	953.39	J/mol×K	1121.84	Joback Calculated Property
Cp,gas	984.02	J/mol×K	1168.06	Joback Calculated Property
Cp,gas	1018.68	J/mol×K	1214.28	Joback Calculated Property
Cp,gas	1057.97	J/mol×K	1260.50	Joback Calculated Property
Cp,gas	1102.53	J/mol×K	1306.71	Joback Calculated Property
Cp,gas	1152.95	J/mol×K	1352.93	Joback Calculated Property
Cp,gas	1209.85	J/mol×K	1399.15	Joback Calculated Property
η	[0.1009143; 0.1126083]	Pa×s	[844.90; 1121.84]
η	0.1009143	Pa×s	844.90	Joback Calculated Property
η	0.1032630	Pa×s	891.06	Joback Calculated Property
η	0.1054271	Pa×s	937.21	Joback Calculated Property
η	0.1074272	Pa×s	983.37	Joback Calculated Property
η	0.1092809	Pa×s	1029.53	Joback Calculated Property
η	0.1110035	Pa×s	1075.68	Joback Calculated Property
η	0.1126083	Pa×s	1121.84	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzo[e]phenanthro[1,10,9,8-opqra]perylene.

Sources

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

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