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1-Hydroxy Tacrine-d4 HCl

CAT: 1596-AR-T01003-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-T01003-01Size:10 Units
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CAS Number
1246816-08-9
Synonyms
9-amino-1,2,3,4-tetrahydroacridin-1-ol-D4; 9-amino-1,2,3,4-tetrahydroacridin-1-ol-D4; 9-Amino-1,2,3,4-tetrahydro-1-acridinol-D4; HP 029-D4; Mentane-D4; P 83-6029A-D4; Velnacrine Hydrogen -D4; Velnacrine -D4;1-hydroxy tacrine
Molecular Formula
C13H10N2OD4. HCl
Molecular Weight
218.29 36.46
API Name
Tacrine

Chemical Information

1-Hydroxy Tacrine-d4 HCl
CAS Number1246816-08-9
PubChem CID71313300
IUPAC Name9-amino-5,6,7,8-tetradeuterio-1,2,3,4-tetrahydroacridin-1-ol;hydrochloride
Molecular FormulaC13H15ClN2O
Molecular Weight254.75
Topological Polar Surface Area59.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count17
Formal Charge0
Complexity258
SMILES
[2H]C1=C(C(=C2C(=C1[2H])C(=C3C(CCCC3=N2)O)N)[2H])[2H].Cl
InChI
InChI=1S/C13H14N2O.ClH/c14-13-8-4-1-2-5-9(8)15-10-6-3-7-11(16)12(10)13;/h1-2,4-5,11,16H,3,6-7H2,(H2,14,15);1H/i1D,2D,4D,5D;
InChIKey
IJWCYOSTVLKCCX-XLJCJYTQSA-N
Chemical Structure
2D Structure
2D structure of 1-Hydroxy Tacrine-d4 HCl
CAS: 1246816-08-9
CID: 71313300
Formula: C13H15ClN2O
MW: 254.75
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight254.75
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass254.1123978
Monoisotopic Mass254.1123978
Topological Polar Surface Area59.1 Ų
Heavy Atom Count17
Formal Charge0
Complexity258
Isotope Atom Count4
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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