Chemical Properties of Naphtho[2,1,8-def]picene (CAS 120835-39-4)

InChI

InChI=1S/C28H16/c1-2-8-20-17(5-1)13-14-23-21(20)15-16-24-22-9-3-6-18-11-12-19-7-4-10-25(28(23)24)27(19)26(18)22/h1-16H

InChI Key

NMORLAMPHCGCIQ-UHFFFAOYSA-N

Formula

C28H16

SMILES

c1ccc2c(c1)ccc1c2ccc2c3cccc4ccc5cccc(c12)c5c43

Molecular Weight¹

352.43

CAS

120835-39-4

• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[812.40; 948.61]	J/mol×K	[998.00; 1272.12]
Cp,gas	812.40	J/mol×K	998.00	Joback Calculated Property
Cp,gas	830.78	J/mol×K	1043.69	Joback Calculated Property
Cp,gas	850.30	J/mol×K	1089.37	Joback Calculated Property
Cp,gas	871.41	J/mol×K	1135.06	Joback Calculated Property
Cp,gas	894.53	J/mol×K	1180.75	Joback Calculated Property
Cp,gas	920.12	J/mol×K	1226.44	Joback Calculated Property
Cp,gas	948.61	J/mol×K	1272.12	Joback Calculated Property
η	[0.0066296; 0.0086256]	Pa×s	[696.82; 998.00]
η	0.0086256	Pa×s	696.82	Joback Calculated Property
η	0.0081346	Pa×s	747.02	Joback Calculated Property
η	0.0077284	Pa×s	797.21	Joback Calculated Property
η	0.0073872	Pa×s	847.41	Joback Calculated Property
η	0.0070968	Pa×s	897.61	Joback Calculated Property
η	0.0068469	Pa×s	947.80	Joback Calculated Property
η	0.0066296	Pa×s	998.00	Joback Calculated Property

Similar Compounds

Find more compounds similar to Naphtho[2,1,8-def]picene.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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