Products for Research Use Only
RegisterLogin

Oxycodone Related Compound B

CAT: 1596-AR-O08887-02Size: 25 UnitsDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1596-AR-O08887-02Size:25 Units
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
71539-52-1
Synonyms
(4R,4aS,7aR,12bS) -4a-hydroxy-9-methoxy-3-methyl-3-oxido-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-one
Molecular Formula
C18H21NO5
API Name
Oxycodone

Chemical Information

Oxycodone N-oxide
CAS Number71539-52-1
PubChem CID71623259
IUPAC Name(4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-3-oxido-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-one
Molecular FormulaC18H21NO5
Molecular Weight331.4
XLogP0.6
Topological Polar Surface Area73.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count24
Formal Charge0
Complexity598
SMILES
C[N+]1(CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)OC)O4)O)[O-]
InChI
InChI=1S/C18H21NO5/c1-19(22)8-7-17-14-10-3-4-12(23-2)15(14)24-16(17)11(20)5-6-18(17,21)13(19)9-10/h3-4,13,16,21H,5-9H2,1-2H3/t13-,16+,17+,18-,19?/m1/s1
InChIKey
GXMDLXQESSRSFB-ZWKGOLINSA-N
Chemical Structure
2D Structure
2D structure of Oxycodone N-oxide
CAS: 71539-52-1
CID: 71623259
Formula: C18H21NO5
MW: 331.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight331.4
XLogP30.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass331.14197277
Monoisotopic Mass331.14197277
Topological Polar Surface Area73.8 Ų
Heavy Atom Count24
Formal Charge0
Complexity598
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
AR-G01687-01Glycopyrrolate Related Compound B
AR-A01010-01Abacavir Related Compound B
AR-B05602-01Bupropion Related Compound B
AR-P27396-01Trimethoprim Related Compound B
AR-T03099-01Tropicamide Related Compound B
AR-R01964-01Ropinirole Related Compound B
AR-R01672-01Risedronate related compound B
AR-M03693-01Mesna Related Compound B
AR-C01383-01Carbinoxamine Related Compound B
AR-F02105-01Fosinopril Related Compound B

Alternative Products

CatalogName
CS-K-00104Oxycodone Related Compound B
CS-EB-01574Oxycodone Related Compound A CII (F0G367)
CS-EB-01576Oxycodone Related Compound C CII (F0I167)
CS-EB-01575Oxycodone Related Compound B CII (F1I028)
CS-ER-01553Oxycodone Related Compound A CII (Secondary Standards traceble to USP)
CS-ER-01555Oxycodone Related Compound C CII (Secondary Standards traceble to USP)
CS-ER-01554Oxycodone Related Compound B CII (Secondary Standards traceble to USP)
MBA94506-01Estazolam Related Compound A
CS-EG-03533Tramadol Related Compound A
CS-T-93662Vinorelbine Related Compound A

Popular Products