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Amfepramone-d10 Hydrochloride

CAT: 0572-TRC-D444787-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D444787-10MGSize:10 mg
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CAS Number
1189500-62-6
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
Cl.[2H]C([2H])([2H])C([2H])([2H])N(C(C)C(=O)c1ccccc1)C([2H])([2H])C([2H])([2H])[2H]
Molecular Formula
C13 2H10 H9 N O . Cl H
Molecular Weight
251.82
InChI
InChI=1S/C13H19NO.ClH/c1-4-14(5-2)11(3)13(15)12-9-7-6-8-10-12;/h6-11H,4-5H2,1-3H3;1H/i1D3,2D3,4D2,5D2;
Additionnal Information
IUPAC name: 2-[bis(1,1,2,2,2-pentadeuterioethyl)amino]-1-phenylpropan-1-one;hydrochloride
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Amfepramone-d10 Hydrochloride
CAS Number1189500-62-6
PubChem CID46781285
IUPAC Name2-[bis(1,1,2,2,2-pentadeuterioethyl)amino]-1-phenylpropan-1-one;hydrochloride
Molecular FormulaC13H20ClNO
Molecular Weight251.82
Topological Polar Surface Area20.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count16
Formal Charge0
Complexity193
SMILES
[2H]C([2H])([2H])C([2H])([2H])N(C(C)C(=O)C1=CC=CC=C1)C([2H])([2H])C([2H])([2H])[2H].Cl
InChI
InChI=1S/C13H19NO.ClH/c1-4-14(5-2)11(3)13(15)12-9-7-6-8-10-12;/h6-11H,4-5H2,1-3H3;1H/i1D3,2D3,4D2,5D2;
InChIKey
ICFXZZFWRWNZMA-IDHUOJFFSA-N
Chemical Structure
2D Structure
2D structure of Amfepramone-d10 Hydrochloride
CAS: 1189500-62-6
CID: 46781285
Formula: C13H20ClNO
MW: 251.82
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight251.82
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass251.1861094
Monoisotopic Mass251.1861094
Topological Polar Surface Area20.3 Ų
Heavy Atom Count16
Formal Charge0
Complexity193
Isotope Atom Count10
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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