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Maprotiline-d5 Hydrochloride

CAT: 0572-TRC-M188002-1MGSize: 1 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M188002-1MGSize:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1794942-12-3
Synonyms
N-Methyl-9,10-ethanoanthracene-9(10H)-propanamine-d5 Hydrochloride; N-Methyl-9,10-ethanoanthracene-9(10H)-propylamine-d5 Hydrochloride; Ba-34276-d5; Deprilept-d5; Ludiomil-d5; Psymion-d5;
Hazard Statement
Harmful if swallowed
Smiles
[2H]C(NC([2H])([2H])[2H])([2H])CCC1(CC2)C3=C(C=CC=C3)C2C4=CC=CC=C41.Cl
Molecular Formula
C20H19D5ClN
Molecular Weight
318.9
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Maprotiline-d5 Hydrochloride
CAS Number1794942-12-3
PubChem CID71749906
IUPAC Name1,1-dideuterio-3-(1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-N-(trideuteriomethyl)propan-1-amine;hydrochloride
Molecular FormulaC20H24ClN
Molecular Weight318.9
Topological Polar Surface Area12
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity339
SMILES
[2H]C([2H])([2H])NC([2H])([2H])CCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24.Cl
InChI
InChI=1S/C20H23N.ClH/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20;/h2-5,7-10,15,21H,6,11-14H2,1H3;1H/i1D3,14D2;
InChIKey
NZDMFGKECODQRY-QHZJUOFTSA-N
Chemical Structure
2D Structure
2D structure of Maprotiline-d5 Hydrochloride
CAS: 1794942-12-3
CID: 71749906
Formula: C20H24ClN
MW: 318.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight318.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass318.1911112
Monoisotopic Mass318.1911112
Topological Polar Surface Area12 Ų
Heavy Atom Count22
Formal Charge0
Complexity339
Isotope Atom Count5
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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