Chemical Properties of Hexabenzo[bc:ef:hi:kl:no:qr]coronene (CAS 190-24-9)

InChI

InChI=1S/C42H18/c1-7-19-21-9-2-11-23-25-13-4-15-27-29-17-6-18-30-28-16-5-14-26-24-12-3-10-22-20(8-1)31(19)37-38(32(21)23)40(34(25)27)42(36(29)30)41(35(26)28)39(37)33(22)24/h1-18H

InChI Key

IVJZBYVRLJZOOQ-UHFFFAOYSA-N

Formula

C42H18

SMILES

c1cc2c3cccc4c5cccc6c7cccc8c9cccc%10c%11cccc%12c(c1)c2c1c(c34)c(c56)c(c78)c(c%109)c1c%12%11

Molecular Weight¹

522.59

CAS

190-24-9

Other Names

• 1:12,2:3,4:5,6:7,8:9,10:11-Hexabenzocoronene
• Hexabenzo[bc,ef,hi,kl,no,qr]coronene

• 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	[1649.96; 2677.06]	J/mol×K	[1423.38; 1742.76]
Cp,gas	1649.96	J/mol×K	1423.38	Joback Calculated Property
Cp,gas	1773.63	J/mol×K	1476.61	Joback Calculated Property
Cp,gas	1914.44	J/mol×K	1529.84	Joback Calculated Property
Cp,gas	2073.78	J/mol×K	1583.07	Joback Calculated Property
Cp,gas	2253.07	J/mol×K	1636.30	Joback Calculated Property
Cp,gas	2453.70	J/mol×K	1689.53	Joback Calculated Property
Cp,gas	2677.06	J/mol×K	1742.76	Joback Calculated Property
η	[15.4036521; 20.6736601]	Pa×s	[1157.32; 1423.38]
η	15.4036521	Pa×s	1157.32	Joback Calculated Property
η	16.3249731	Pa×s	1201.66	Joback Calculated Property
η	17.2300107	Pa×s	1246.01	Joback Calculated Property
η	18.1179079	Pa×s	1290.35	Joback Calculated Property
η	18.9880560	Pa×s	1334.69	Joback Calculated Property
η	19.8400516	Pa×s	1379.04	Joback Calculated Property
η	20.6736601	Pa×s	1423.38	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hexabenzo[bc:ef:hi:kl:no:qr]coronene.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.