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2D Structure
Also known as: (9-isopropyl-9-azabicyclo[3.3.1]nonan-3-yl)methanol, 1209437-82-0, Akos026743601, Cs-0355069, En300-89035
Molecular Formula
C12H23NO
Molecular Weight
197.32  g/mol
InChI Key
UDXYDGOWXCGIFZ-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-yl)methanol
2.1.2 InChI
InChI=1S/C12H23NO/c1-9(2)13-11-4-3-5-12(13)7-10(6-11)8-14/h9-12,14H,3-8H2,1-2H3
2.1.3 InChI Key
UDXYDGOWXCGIFZ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)N1C2CCCC1CC(C2)CO
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. (9-isopropyl-9-azabicyclo[3.3.1]nonan-3-yl)methanol

2. 1209437-82-0

3. Akos026743601

4. Cs-0355069

5. En300-89035

2.3 Create Date
2010-06-21
3 Chemical and Physical Properties
Molecular Weight 197.32 g/mol
Molecular Formula C12H23NO
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area23.5
Heavy Atom Count14
Formal Charge0
Complexity179
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1