Chemical Properties of Benzo(b)carbazole (CAS 243-28-7)

InChI

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

InChI Key

ROEOVWIEALGNLM-UHFFFAOYSA-N

Formula

C16H11N

SMILES

c1ccc2cc3c(cc2c1)[nH]c1ccccc13

Molecular Weight¹

217.27

CAS

243-28-7

Other Names

• 5H-Benzo[b]carbazole
• Benzocarbazole
• 2,3-Benzcarbazole
• 2,3-Benzocarbazole

• 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).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
IE	7.10 ± 0.10	eV	NIST
log10WS	-6.10		Crippen Calculated Property
logPoct/wat	3.992		Crippen Calculated Property
McVol	168.440	ml/mol	McGowan Calculated Property
Inp	[407.54; 2442.00]
Inp	Outlier 2442.00		NIST
Inp	409.63		NIST
Inp	410.12		NIST
Inp	409.31		NIST
Inp	409.31		NIST
Inp	410.12		NIST
Inp	407.54		NIST

Similar Compounds

Find more compounds similar to Benzo(b)carbazole.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.