Chemical Properties of Pseudotropine (CAS 135-97-7)

InChI

InChI=1S/C9H17NO/c1-9(11)5-7-3-4-8(6-9)10(7)2/h7-8,11H,3-6H2,1-2H3

InChI Key

CELYWWIEPXTVDS-UHFFFAOYSA-N

Formula

C8H15NO

SMILES

CN1C2CCC1CC(C)(O)C2

Molecular Weight¹

141.21

CAS

135-97-7

Other Names

• exo-8-methyl-8-azabicyclo[3.2.1]octan-3-ol
• 8-Azabicyclo[3.2.1]octan-3-ol, 8-methyl-, exo-

• 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	7.90 ± 0.15	eV	NIST
log10WS	-1.55		Crippen Calculated Property
logPoct/wat	0.994		Crippen Calculated Property
McVol	131.800	ml/mol	McGowan Calculated Property
Inp	[1185.00; 1233.70]
Inp	1233.70		NIST
Inp	1185.00		NIST
Inp	1185.00		NIST
Inp	1185.00		NIST
Inp	1233.70		NIST

Similar Compounds

Find more compounds similar to Pseudotropine.

Sources

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

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