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(+)-N-Desmethyl Tramadol-d3

CAT: 0572-TRC-D294727-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D294727-25MGSize:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1261395-92-9
Synonyms
(+)-N-Desmethyl Tramadol-d3; rac N-Desmethyl Tramadol-d3; N-Desmethyltramadol-D3 (N-methyl-D3); rel-(1R,2R)-1-(3-Methoxyphenyl)-2-[[(methyl-d3)amino]methyl]cyclohexanol; cis-1-(3-Methoxyphenyl)-2-(methyl-d3-aminomethyl)cyclohexanol; N-Demethyltramadol-d3; N-Desmethyltramadol-d3; N-Mo
Hazard Statement
No Data Available
Smiles
[2H]C([2H])([2H])NC[C@H]1CCCC[C@]1(O)c2cccc(OC)c2
Molecular Formula
C15 D3 H20 N O2
Molecular Weight
252.367
InChI
InChI=1S/C15H23NO2/c1-16-11-13-6-3-4-9-15(13,17)12-7-5-8-14(10-12)18-2/h5,7-8,10,13,16-17H,3-4,6,9,11H2,1-2H3/t13-,15+/m1/s1/i1D3
Additionnal Information
IUPAC name: (1R,2R)-1-(3-methoxyphenyl)-2-[(trideuteriomethylamino)methyl]cyclohexan-1-ol
Shipping Conditions
Room Temperature

Chemical Information

(+)-N-Desmethyl Tramadol-d3
CAS Number1261395-92-9
PubChem CID49849455
IUPAC Namecis-(1R,2R)-1-(3-methoxyphenyl)-2-[(trideuteriomethylamino)methyl]cyclohexan-1-ol
Molecular FormulaC15H23NO2
Molecular Weight252.37
XLogP2.7
Topological Polar Surface Area41.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity259
SMILES
[2H]C([2H])([2H])NC[C@H]1CCCC[C@@]1(C2=CC(=CC=C2)OC)O
InChI
InChI=1S/C15H23NO2/c1-16-11-13-6-3-4-9-15(13,17)12-7-5-8-14(10-12)18-2/h5,7-8,10,13,16-17H,3-4,6,9,11H2,1-2H3/t13-,15+/m1/s1/i1D3
InChIKey
VUMQHLSPUAFKKK-RSGFOGQCSA-N
Chemical Structure
2D Structure
2D structure of (+)-N-Desmethyl Tramadol-d3
CAS: 1261395-92-9
CID: 49849455
Formula: C15H23NO2
MW: 252.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight252.37
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass252.191709214
Monoisotopic Mass252.191709214
Topological Polar Surface Area41.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity259
Isotope Atom Count3
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
CS-T-97614(-) -N-Desmethyl Tramadol-d3
CS-T-97613(+) -N-Desmethyl Tramadol-d3
458834-01(-) -N-Desmethyl Tramadol-d3 discontinued
458835-01(+) -N-Desmethyl Tramadol-d3 discontinued
AR-T02744-01N-Desmethyl- (-) -cis-Tramadol-d3
AR-T02745-01N-Desmethyl- (+) -cis-Tramadol-d3
CS-O-54795N-Desmethyl N-nitroso Tramadol-d3
CS-O-58191N-Nitroso N-Desmethyl Tramadol-D3 Hydrochloride
008719Rac N-Desmethyl Tramadol-d3 Hydrochloride discontinued
AR-T02732-01Rac-N-Desmethyl Tramadol-d3 (HCl salt)

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