Chemical Properties of 1H-Carbazole, 2,3,4,9-tetrahydro- (CAS 942-01-8)

InChI

InChI=1S/C12H13N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1,3,5,7,13H,2,4,6,8H2

InChI Key

XKLNOVWDVMWTOB-UHFFFAOYSA-N

Formula

C12H13N

SMILES

c1ccc2c3c([nH]c2c1)CCCC3

Molecular Weight¹

171.24

CAS

942-01-8

Other Names

• Carbazole, 1,2,3,4-tetrahydro-
• 1,2,3,4-Tetrahydrocarbazole
• 1H-Indole, 2,3-(1,4-butanediyl)-
• 2,3-Tetramethylene-1H-indole
• 2,3-Tetramethyleneindole
• Carbazole, 5,6,7,8-tetrahydro-
• 5,6,7,8-Tetrahydrocarbazole
• Tetrahydrocarbazole
• NSC 17329

• 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.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-4.00		Crippen Calculated Property
logPoct/wat	2.565		Crippen Calculated Property
McVol	140.140	ml/mol	McGowan Calculated Property
Inp	[306.76; 1811.80]
Inp	1809.00		NIST
Inp	1800.40		NIST
Inp	1800.00		NIST
Inp	1786.60		NIST
Inp	1800.40		NIST
Inp	1811.80		NIST
Inp	1786.60		NIST
Inp	1800.40		NIST
Inp	1811.80		NIST
Inp	1800.40		NIST
Inp	1800.00		NIST
Inp	Outlier 306.76		NIST
Inp	Outlier 306.76		NIST
Tboil	600.70	K	NIST

Similar Compounds

Find more compounds similar to 1H-Carbazole, 2,3,4,9-tetrahydro-.

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.