Chemical Properties of Dibenzo[j,lm]phenanthro[5,4,3-abcd]perylene (CAS 117726-80-4)

InChI

InChI=1S/C36H18/c1-2-8-25-23(7-1)24-9-3-5-20-15-17-28-34-26-10-4-6-19-11-12-21-13-14-22-16-18-27(33(25)35(28)29(20)24)36(34)32(22)31(21)30(19)26/h1-18H

InChI Key

KDFQDWZUGQQMRZ-UHFFFAOYSA-N

Formula

C36H18

SMILES

c1ccc2c(c1)c1cccc3ccc4c5c6cccc7ccc8ccc9ccc(c2c4c31)c5c9c8c76

Molecular Weight¹

450.53

CAS

117726-80-4

• 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	[1165.67; 1566.95]	J/mol×K	[1237.32; 1526.05]
Cp,gas	1165.67	J/mol×K	1237.32	Joback Calculated Property
Cp,gas	1213.56	J/mol×K	1285.44	Joback Calculated Property
Cp,gas	1268.03	J/mol×K	1333.56	Joback Calculated Property
Cp,gas	1329.84	J/mol×K	1381.68	Joback Calculated Property
Cp,gas	1399.76	J/mol×K	1429.81	Joback Calculated Property
Cp,gas	1478.54	J/mol×K	1477.93	Joback Calculated Property
Cp,gas	1566.95	J/mol×K	1526.05	Joback Calculated Property
η	[0.1858032; 0.2034462]	Pa×s	[935.20; 1237.32]
η	0.1858032	Pa×s	935.20	Joback Calculated Property
η	0.1893636	Pa×s	985.55	Joback Calculated Property
η	0.1926365	Pa×s	1035.91	Joback Calculated Property
η	0.1956549	Pa×s	1086.26	Joback Calculated Property
η	0.1984470	Pa×s	1136.61	Joback Calculated Property
η	0.2010371	Pa×s	1186.97	Joback Calculated Property
η	0.2034462	Pa×s	1237.32	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dibenzo[j,lm]phenanthro[5,4,3-abcd]perylene.

Sources

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

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