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Memantine Impurity B

CAT: 1299-RM-M132028-04Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-M132028-04Size:100 mg
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CAS Number
63971-25-5
Synonyms
(1s,3r,5R,7S) -3-amino-5,7-dimethyladamantan-1-ol
Molecular Formula
C12H21NO
Molecular Weight
195.31
Target Alternative Name
Memantine
Product Name Synonym
(1s,3r,5R,7S) -3-amino-5,7-dimethyladamantan-1-ol

Chemical Information

3-Amino-5,7-dimethyladamantan-1-ol

3-Amino-5,7-dimethyl-1-adamantanol is a tertiary alcohol.

CAS Number63971-25-5
PubChem CID3382167
IUPAC Name3-amino-5,7-dimethyladamantan-1-ol
Molecular FormulaC12H21NO
Molecular Weight195.30
XLogP1.3
Topological Polar Surface Area46.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity281
SMILES
CC12CC3(CC(C1)(CC(C2)(C3)O)N)C
InChI
InChI=1S/C12H21NO/c1-9-3-10(2)5-11(13,4-9)8-12(14,6-9)7-10/h14H,3-8,13H2,1-2H3
InChIKey
HSRBAOBUCHCHTQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Amino-5,7-dimethyladamantan-1-ol
CAS: 63971-25-5
CID: 3382167
Formula: C12H21NO
MW: 195.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight195.30
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass195.162314293
Monoisotopic Mass195.162314293
Topological Polar Surface Area46.3 Ų
Heavy Atom Count14
Formal Charge0
Complexity281
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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IM57476-01Memantine impurity IV
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