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Epinephrine-d3

CAT: 1596-AR-E01505-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-E01505-02Size:25 Units
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CAS Number
1217733-17-9
Synonyms
(R) -4- (1-hydroxy-2- (methylamino) ethyl) benzene-1,2-diol-D3; L- (-) -Epinephrine-d3; 4-[ (1R) -1-Hydroxy-2- (methylamino-d3) ethyl]-1,2-benzenediol; (R) -Epinephrine-d3; Renoform-d3; Renostypticin-d3; Adnephrine-d3; Adrenal-d3; Adrenalin-d3; Adrenaline-d3; l-Epinephrine-d3; Levoepinephrine-d3
Molecular Formula
C9H10NO3D3
Molecular Weight
186.23
API Name
Epinephrine

Chemical Information

L-(-)-Epinephrine-d3
CAS Number1217733-17-9
PubChem CID49849560
IUPAC Name4-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]benzene-1,2-diol
Molecular FormulaC9H13NO3
Molecular Weight186.22
XLogP-1.4
Topological Polar Surface Area72.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity154
SMILES
[2H]C([2H])([2H])NC[C@@H](C1=CC(=C(C=C1)O)O)O
InChI
InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m0/s1/i1D3
InChIKey
UCTWMZQNUQWSLP-XYFUXNRQSA-N
Chemical Structure
2D Structure
2D structure of L-(-)-Epinephrine-d3
CAS: 1217733-17-9
CID: 49849560
Formula: C9H13NO3
MW: 186.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight186.22
XLogP3-1.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass186.10837351
Monoisotopic Mass186.10837351
Topological Polar Surface Area72.7 Ų
Heavy Atom Count13
Formal Charge0
Complexity154
Isotope Atom Count3
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes