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Tacrine (hydrochloride)

CAT: 0127-OR1005484Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1005484Size:100 mg
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CAS Number
1684-40-8
Purity
98%
Smiles
NC1=C(CCCC2)C2=NC3=CC=CC=C31.[H]Cl

Chemical Information

Tacrine Hydrochloride

1,2,3,4-tetrahydro-9-aminoacridine hydrochloride monohydrate appears as yellow needles (from concentrated hydrochloric acid); white powder. pH of 1.5% solution: 4.5-6. Bitter taste. (NTP, 1992)

CAS Number1684-40-8
PubChem CID2723754
IUPAC Name1,2,3,4-tetrahydroacridin-9-amine;hydrochloride
Molecular FormulaC13H15ClN2
Molecular Weight234.72
Topological Polar Surface Area38.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count16
Formal Charge0
Complexity229
SMILES
C1CCC2=NC3=CC=CC=C3C(=C2C1)N.Cl
InChI
InChI=1S/C13H14N2.ClH/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;/h1,3,5,7H,2,4,6,8H2,(H2,14,15);1H
InChIKey
ZUFVXZVXEJHHBN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tacrine Hydrochloride
CAS: 1684-40-8
CID: 2723754
Formula: C13H15ClN2
MW: 234.72
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight234.72
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass234.0923762
Monoisotopic Mass234.0923762
Topological Polar Surface Area38.9 Ų
Heavy Atom Count16
Formal Charge0
Complexity229
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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