Chemical Properties of 5,16:8,13-Diethenodibenzo[a,g]cyclododecane, 6,7,14,15-tetrahydro (CAS 17341-02-5)

InChI

InChI=1S/C24H24/c1-2-6-22-18-10-9-17(21(22)5-1)13-14-19-11-12-20(16-15-18)24-8-4-3-7-23(19)24/h1-10,19-20H,11-16H2/t19-,20?/m1/s1

InChI Key

YWFIZNFETZCKEP-FIWHBWSRSA-N

Formula

C24H20

SMILES

c1ccc2c(c1)C1CCc3ccc(c4ccccc34)CCC2CC1

Molecular Weight¹

308.42

CAS

17341-02-5

Other Names

• anti-(5,16:8,13)-Diethenodibenzo[a,g] cyclododecene 6,7,14,15-tetrahydro-
• [2,2]-(1,4)-Naphthalenophane

• 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

Property	Value	Unit	Source
ΔfG°	551.08	kJ/mol	Joback Calculated Property
ΔfH°gas	224.31	kJ/mol	Joback Calculated Property
ΔfusH°	33.92	kJ/mol	Joback Calculated Property
ΔvapH°	77.37	kJ/mol	Joback Calculated Property
IE	[7.30; 7.50]	eV
IE	7.30	eV	NIST
IE	7.50	eV	NIST
log10WS	-7.85		Crippen Calculated Property
logPoct/wat	6.380		Crippen Calculated Property
McVol	260.320	ml/mol	McGowan Calculated Property
Pc	1810.77	kPa	Joback Calculated Property
Tboil	857.82	K	Joback Calculated Property
Tc	1123.14	K	Joback Calculated Property
Tfus	512.18	K	Joback Calculated Property
Vc	0.984	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[823.37; 928.41]	J/mol×K	[857.82; 1123.14]
Cp,gas	823.37	J/mol×K	857.82	Joback Calculated Property
Cp,gas	843.52	J/mol×K	902.04	Joback Calculated Property
Cp,gas	862.29	J/mol×K	946.26	Joback Calculated Property
Cp,gas	879.92	J/mol×K	990.48	Joback Calculated Property
Cp,gas	896.65	J/mol×K	1034.70	Joback Calculated Property
Cp,gas	912.74	J/mol×K	1078.92	Joback Calculated Property
Cp,gas	928.41	J/mol×K	1123.14	Joback Calculated Property
η	[0.0005822; 0.0020192]	Pa×s	[512.18; 857.82]
η	0.0020192	Pa×s	512.18	Joback Calculated Property
η	0.0014780	Pa×s	569.79	Joback Calculated Property
η	0.0011456	Pa×s	627.39	Joback Calculated Property
η	0.0009268	Pa×s	685.00	Joback Calculated Property
η	0.0007749	Pa×s	742.61	Joback Calculated Property
η	0.0006648	Pa×s	800.21	Joback Calculated Property
η	0.0005822	Pa×s	857.82	Joback Calculated Property

Similar Compounds

Find more compounds similar to 5,16:8,13-Diethenodibenzo[a,g]cyclododecane, 6,7,14,15-tetrahydro.

Sources

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

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