Chemical Properties of 3,7-Diazabicyclo[3.3.1]nonane, 3,7-dimethyl- (CAS 14789-33-4)

InChI

InChI=1S/C9H18N2/c1-10-4-8-3-9(5-10)7-11(2)6-8/h8-9H,3-7H2,1-2H3

InChI Key

XVHVEMJNJDESBO-UHFFFAOYSA-N

Formula

C9H18N2

SMILES

CN1CC2CC(C1)CN(C)C2

Molecular Weight¹

154.25

CAS

14789-33-4

• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
IE	[6.80; 7.84]	eV
IE	6.80	eV	NIST
IE	7.84	eV	NIST
log10WS	-0.04		Crippen Calculated Property
logPoct/wat	0.500		Crippen Calculated Property
McVol	135.910	ml/mol	McGowan Calculated Property

Similar Compounds

Find more compounds similar to 3,7-Diazabicyclo[3.3.1]nonane, 3,7-dimethyl-.

Sources

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

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