Chemical Properties of 2-Aminochrysene (CAS 789-47-9)

InChI

InChI=1S/C18H13N/c19-14-7-10-16-13(11-14)6-9-17-15-4-2-1-3-12(15)5-8-18(16)17/h1-11H,19H2

InChI Key

KSDIHKMNSYWRFB-UHFFFAOYSA-N

Formula

C18H13N

SMILES

Nc1ccc2c(ccc3c4ccccc4ccc23)c1

Molecular Weight¹

243.30

CAS

789-47-9

Other Names

• 2-Chrysenamine
• chrysene-2-amine

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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	[523.87; 596.64]	J/mol×K	[782.33; 1050.06]
Cp,gas	523.87	J/mol×K	782.33	Joback Calculated Property
Cp,gas	537.53	J/mol×K	826.95	Joback Calculated Property
Cp,gas	550.29	J/mol×K	871.57	Joback Calculated Property
Cp,gas	562.36	J/mol×K	916.19	Joback Calculated Property
Cp,gas	573.96	J/mol×K	960.81	Joback Calculated Property
Cp,gas	585.32	J/mol×K	1005.44	Joback Calculated Property
Cp,gas	596.64	J/mol×K	1050.06	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Aminochrysene.

Sources

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

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