Chemical Properties of Tetrahydrorhombifoline (CAS 3382-84-1)

InChI

InChI=1S/C15H24N2O/c1-2-3-7-16-9-12-8-13(11-16)14-5-4-6-15(18)17(14)10-12/h2,12-14H,1,3-11H2

InChI Key

OKTIETCHYDTVGN-UHFFFAOYSA-N

Formula

C15H24N2O

SMILES

C=CCCN1CC2CC(C1)C1CCCC(=O)N1C2

Molecular Weight¹

248.36

CAS

3382-84-1

• 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
log10WS	-2.18		Crippen Calculated Property
logPoct/wat	1.895		Crippen Calculated Property
McVol	206.860	ml/mol	McGowan Calculated Property
Inp	[2040.00; 2080.00]
Inp	2050.00		NIST
Inp	Outlier 2080.00		NIST
Inp	2050.00		NIST
Inp	2040.00		NIST
Inp	2050.00		NIST
Inp	2050.00		NIST
Inp	2050.00		NIST
Inp	2050.00		NIST
Inp	2050.00		NIST

Similar Compounds

Find more compounds similar to Tetrahydrorhombifoline.

Sources

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