Chemical Properties of Benzo[a]carbazole

InChI

InChI=1S/C16H11N/c1-2-6-12-11(5-1)9-10-14-13-7-3-4-8-15(13)17-16(12)14/h1-10,17H

InChI Key

MYKQKWIPLZEVOW-UHFFFAOYSA-N

Formula

C16H11N

SMILES

c1ccc2c(c1)ccc1c3ccccc3[nH]c21

Molecular Weight¹

217.27

Other Names

• Benzo[a]carbazole
• 1,2-Benzcarbazole
• 1,2-Benzocarbazole
• 11-Azachrysofluorene

• 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	276.11	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	109.66	kJ/mol	Relay (1.0) Calculated Property
IE	7.10 ± 0.10	eV	NIST
log10WS	-5.94		Relay (1.0) Calculated Property
logPoct/wat	3.992		Crippen Calculated Property
McVol	168.440	ml/mol	McGowan Calculated Property
Pc	3260.93	kPa	Relay (1.0-beta) Calculated Property
Inp	[400.00; 403.50]
Inp	403.50		NIST
Inp	402.22		NIST
Inp	401.81		NIST
Inp	400.00		NIST
Tboil	705.47	K	Relay (1.0) Calculated Property
Tc	1027.64	K	Relay (1.0) Calculated Property
Tfus	518.49	K	Relay (1.0) Calculated Property
Vc	0.649	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 Benzo[a]carbazole.

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.