Chemical Properties of Dinaphtho-[2,1,8-c,d,a:2',1',8'-nop]heptacene (CAS 190-09-0)

InChI

InChI=1S/C42H22/c1-3-23-7-9-27-15-33-19-29-18-32-22-38-34(16-28-10-8-24-4-2-6-26-12-14-36(38)42(28)40(24)26)20-30(32)17-31(29)21-37(33)35-13-11-25(5-1)39(23)41(27)35/h1-22H

InChI Key

IQAQPYAQWJUAGG-UHFFFAOYSA-N

Formula

C42H22

SMILES

c1cc2ccc3cc4cc5cc6cc7c(cc6cc5cc4c4ccc(c1)c2c34)cc1ccc2cccc3ccc7c1c23

Molecular Weight¹

526.62

CAS

190-09-0

Other Names

• Dinaphtho[2,1,8-c1d1a:2',1',8'-nop]heptacene

• 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).
• 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).
• 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	[1572.00; 2267.15]	J/mol×K	[1406.26; 1722.20]
Cp,gas	1572.00	J/mol×K	1406.26	Joback Calculated Property
Cp,gas	1656.06	J/mol×K	1458.92	Joback Calculated Property
Cp,gas	1751.42	J/mol×K	1511.57	Joback Calculated Property
Cp,gas	1859.15	J/mol×K	1564.23	Joback Calculated Property
Cp,gas	1980.30	J/mol×K	1616.89	Joback Calculated Property
Cp,gas	2115.95	J/mol×K	1669.55	Joback Calculated Property
Cp,gas	2267.15	J/mol×K	1722.20	Joback Calculated Property
η	[0.1356750; 0.1425859]	Pa×s	[1041.76; 1406.26]
η	0.1425859	Pa×s	1041.76	Joback Calculated Property
η	0.1410878	Pa×s	1102.51	Joback Calculated Property
η	0.1397597	Pa×s	1163.26	Joback Calculated Property
η	0.1385740	Pa×s	1224.01	Joback Calculated Property
η	0.1375092	Pa×s	1284.76	Joback Calculated Property
η	0.1365476	Pa×s	1345.51	Joback Calculated Property
η	0.1356750	Pa×s	1406.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dinaphtho-[2,1,8-c,d,a:2',1',8'-nop]heptacene.

Sources

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

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