Chemical Properties of Dibenzocarbazole

InChI

InChI=1S/C20H13N/c1-3-7-15-11-19-17(9-13(15)5-1)18-10-14-6-2-4-8-16(14)12-20(18)21-19/h1-12,21H

InChI Key

VWYJRLCUBVCRPR-UHFFFAOYSA-N

Formula

C20H13N

SMILES

c1ccc2cc3c(cc2c1)[nH]c1cc2ccccc2cc13

Molecular Weight¹

267.32

• Δ_fH°_gas : Enthalpy of formation 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).
• 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
ΔfH°gas	340.60	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	136.10	kJ/mol	Relay (1.0) Calculated Property
IE	6.89	eV	Relay (1.0) Calculated Property
log10WS	-8.13		Relay (1.0) Calculated Property
logPoct/wat	5.146		Crippen Calculated Property
McVol	205.340	ml/mol	McGowan Calculated Property
Pc	2781.94	kPa	Relay (1.0-beta) Calculated Property
Inp	[497.70; 2616.00]
Inp	2616.00		NIST
Inp	497.70		NIST
Inp	2616.00		NIST
Inp	497.70		NIST
Tboil	780.14	K	Relay (1.0) Calculated Property
Tc	1132.14	K	Relay (1.0) Calculated Property
Tfus	621.45	K	Relay (1.0) Calculated Property
Vc	0.785	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Dibenzocarbazole.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen 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.