Chemical Properties of Dinaphtho[1,2-g:1',2'-g']naphtho[2,1-c:7,8-c']diphenanthrene (CAS 57468-46-9)

InChI

InChI=1S/C50H28/c1-3-7-40-29(5-1)9-11-31-13-15-33-17-19-35-21-23-37-25-27-39-28-26-38-24-22-36-20-18-34-16-14-32-12-10-30-6-2-4-8-41(30)43(32)45(34)47(36)49(38)50(39)48(37)46(35)44(33)42(31)40/h1-28H

InChI Key

WRIBLYWAWHZTKJ-UHFFFAOYSA-N

Formula

C50H28

SMILES

c1ccc2c(c1)ccc1ccc3ccc4ccc5ccc6ccc7ccc8ccc9ccc%10ccc%11ccccc%11c%10c9c8c7c6c5c4c3c12

Molecular Weight¹

628.76

CAS

57468-46-9

• ω : Acentric Factor.
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[583.44; 1451.33]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-2.79350e+02
Coefficient B			4.03920e+00
Coefficient C			-3.56092e-03
Coefficient D			1.25240e-06
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	583.44	J/mol×K	273.00	Calculated Property
Cp,gas	759.40	J/mol×K	353.78	Calculated Property
Cp,gas	906.24	J/mol×K	434.56	Calculated Property
Cp,gas	1027.92	J/mol×K	515.33	Calculated Property
Cp,gas	1128.39	J/mol×K	596.11	Calculated Property
Cp,gas	1211.62	J/mol×K	676.89	Calculated Property
Cp,gas	1281.57	J/mol×K	757.67	Calculated Property
Cp,gas	1342.19	J/mol×K	838.44	Calculated Property
Cp,gas	1397.46	J/mol×K	919.22	Calculated Property
Cp,gas	1451.33	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0382713; 0.0318264]	Pa×s	[1164.58; 1402.46]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-4.35023e+00
Coefficient B			1.26610e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			1164.58
Temperature range, max.			1402.46
η	0.0382713	Pa×s	1164.58	Calculated Property
η	0.0373590	Pa×s	1191.01	Calculated Property
η	0.0365066	Pa×s	1217.44	Calculated Property
η	0.0357087	Pa×s	1243.87	Calculated Property
η	0.0349604	Pa×s	1270.31	Calculated Property
η	0.0342573	Pa×s	1296.74	Calculated Property
η	0.0335956	Pa×s	1323.17	Calculated Property
η	0.0329719	Pa×s	1349.60	Calculated Property
η	0.0323831	Pa×s	1376.03	Calculated Property
η	0.0318264	Pa×s	1402.46	Calculated Property

Similar Compounds

Find more compounds similar to Dinaphtho[1,2-g:1',2'-g']naphtho[2,1-c:7,8-c']diphenanthrene.

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.