Chemical Properties of Benzo(c)phenanthren-2-amine (CAS 4235-06-7)

InChI

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

InChI Key

RUDUZSVUMOSISI-UHFFFAOYSA-N

Formula

C18H13N

SMILES

Nc1ccc2ccc3ccc4ccccc4c3c2c1

Molecular Weight¹

243.30

CAS

4235-06-7

Other Names

• 2-Bnzo[c]phenanthrenamine
• Benzo[c]phenanthrene, 2-amino

• 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).
• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ΔfG°	570.60	kJ/mol	Joback Calculated Property
ΔfH°gas	394.27	kJ/mol	Joback Calculated Property
ΔfusH°	31.50	kJ/mol	Joback Calculated Property
ΔvapH°	75.48	kJ/mol	Joback Calculated Property
log10WS	-6.52		Crippen Calculated Property
logPoct/wat	4.728		Crippen Calculated Property
McVol	192.320	ml/mol	McGowan Calculated Property
Pc	2865.80	kPa	Joback Calculated Property
Inp	[450.10; 450.10]
Inp	450.10		NIST
Inp	450.10		NIST
Tboil	782.33	K	Joback Calculated Property
Tc	1050.06	K	Joback Calculated Property
Tfus	537.96	K	Joback Calculated Property
Vc	0.731	m3/kmol	Joback Calculated Property

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 Benzo(c)phenanthren-2-amine.

Sources

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

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