Chemical Properties of Benz(a)anthracene, 7,12-diethyl- (CAS 16354-52-2)

InChI

InChI=1S/C22H20/c1-3-16-19-11-7-8-12-20(19)17(4-2)22-18-10-6-5-9-15(18)13-14-21(16)22/h5-14H,3-4H2,1-2H3

InChI Key

CIFPUMMYFBMFKK-UHFFFAOYSA-N

Formula

C22H20

SMILES

CCc1c2ccccc2c(CC)c2c1ccc1ccccc12

Molecular Weight¹

284.39

CAS

16354-52-2

Other Names

• 9,10-Diethyl-1,2-benzanthracene
• 7,12-Diethylbenz[a]anthracene

• 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).
• 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	[680.51; 767.56]	J/mol×K	[806.30; 1049.37]
Cp,gas	680.51	J/mol×K	806.30	Joback Calculated Property
Cp,gas	696.76	J/mol×K	846.81	Joback Calculated Property
Cp,gas	712.09	J/mol×K	887.32	Joback Calculated Property
Cp,gas	726.66	J/mol×K	927.84	Joback Calculated Property
Cp,gas	740.66	J/mol×K	968.35	Joback Calculated Property
Cp,gas	754.24	J/mol×K	1008.86	Joback Calculated Property
Cp,gas	767.56	J/mol×K	1049.37	Joback Calculated Property
η	[0.0005657; 0.0014451]	Pa×s	[512.30; 806.30]
η	0.0014451	Pa×s	512.30	Joback Calculated Property
η	0.0011545	Pa×s	561.30	Joback Calculated Property
η	0.0009562	Pa×s	610.30	Joback Calculated Property
η	0.0008144	Pa×s	659.30	Joback Calculated Property
η	0.0007093	Pa×s	708.30	Joback Calculated Property
η	0.0006288	Pa×s	757.30	Joback Calculated Property
η	0.0005657	Pa×s	806.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benz(a)anthracene, 7,12-diethyl-.

Sources

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

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