Chemical Properties of [14]Helicene (CAS 57483-71-3)

InChI

InChI=1S/C58H32/c1-3-7-46-33(5-1)9-11-35-13-15-37-17-19-39-21-23-41-25-27-43-29-31-45-32-30-44-28-26-42-24-22-40-20-18-38-16-14-36-12-10-34-6-2-4-8-47(34)49(36)51(38)53(40)55(42)57(44)58(45)56(43)54(41)52(39)50(37)48(35)46/h1-32H

InChI Key

FYHJTLVERBIHKT-UHFFFAOYSA-N

Formula

C58H32

SMILES

c1ccc2c(c1)ccc1ccc3ccc4ccc5ccc6ccc7ccc8ccc9ccc%10ccc%11ccc%12ccc%13ccccc%13c%12c%11c%10c9c8c7c6c5c4c3c12

Molecular Weight¹

728.87

CAS

57483-71-3

Other Names

• Diphenanthro[4,3-g:4',3'-g']naphtho[2,1-c:7,8-c']diphenanthrene

• 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	[3456.59; 6701.21]	J/mol×K	[1859.62; 2342.70]
Cp,gas	3456.59	J/mol×K	1859.62	Joback Calculated Property
Cp,gas	3840.73	J/mol×K	1940.13	Joback Calculated Property
Cp,gas	4281.43	J/mol×K	2020.65	Joback Calculated Property
Cp,gas	4783.25	J/mol×K	2101.16	Joback Calculated Property
Cp,gas	5350.77	J/mol×K	2181.67	Joback Calculated Property
Cp,gas	5988.57	J/mol×K	2262.19	Joback Calculated Property
Cp,gas	6701.21	J/mol×K	2342.70	Joback Calculated Property
η	[0.0705303; 0.0925601]	Pa×s	[1345.18; 1859.62]
η	0.0925601	Pa×s	1345.18	Joback Calculated Property
η	0.0872679	Pa×s	1430.92	Joback Calculated Property
η	0.0828278	Pa×s	1516.66	Joback Calculated Property
η	0.0790542	Pa×s	1602.40	Joback Calculated Property
η	0.0758107	Pa×s	1688.14	Joback Calculated Property
η	0.0729954	Pa×s	1773.88	Joback Calculated Property
η	0.0705303	Pa×s	1859.62	Joback Calculated Property

Similar Compounds

Find more compounds similar to [14]Helicene.

Sources

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

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