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Oxycodone EP Impurity C HCl

CAT: 1596-AR-O08886-06Size: 250 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-O08886-06Size:250 Units
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CAS Number
52446-25-0
Synonyms
(4R,4aS,7aR,12bS) -4a-hydroxy-9-methoxy-1,2,3,4,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one; hydrochloride
Molecular Formula
C17H19NO4.HCl
API Name
Oxycodone

Chemical Information

Noroxycodone hydrochloride
CAS Number52446-25-0
PubChem CID91971670
IUPAC Name(4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-1,2,3,4,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;hydrochloride
Molecular FormulaC17H20ClNO4
Molecular Weight337.8
Topological Polar Surface Area67.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count23
Formal Charge0
Complexity525
SMILES
COC1=C2C3=C(C[C@@H]4[C@]5([C@]3(CCN4)[C@@H](O2)C(=O)CC5)O)C=C1.Cl
InChI
InChI=1S/C17H19NO4.ClH/c1-21-11-3-2-9-8-12-17(20)5-4-10(19)15-16(17,6-7-18-12)13(9)14(11)22-15;/h2-3,12,15,18,20H,4-8H2,1H3;1H/t12-,15+,16+,17-;/m1./s1
InChIKey
IGNAMRAQFUFUMH-KCTCKCTRSA-N
Chemical Structure
2D Structure
2D structure of Noroxycodone hydrochloride
CAS: 52446-25-0
CID: 91971670
Formula: C17H20ClNO4
MW: 337.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight337.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass337.1080858
Monoisotopic Mass337.1080858
Topological Polar Surface Area67.8 Ų
Heavy Atom Count23
Formal Charge0
Complexity525
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
CS-DH-00024Oxycodone Impurity D
RM-O240411-01Oxycodone Impurity 4
RM-O240412-01Oxycodone Impurity 5
RM-O240410-01Oxycodone Impurity 3
RM-O240408-01Oxycodone Impurity 2
RM-O240407-01Oxycodone Impurity 1
RM-O240401-01Oxycodone Hydrochloride EP Impurity A
CS-EG-02701Oxycodone impurity D (Y0000453)
CS-T-94097Oxycodone EP Impurity B
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