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Isotope-labelled compounds

Oxycodone-D6

Also known as (3-(Methoxy-d3)-N-(methyl-d3))oxycodone, (3-(Methoxy-d3)-N-(methyl-d3))oxycodeinone, Oxycodone, (3-(methoxy-d3)-N-(methyl-d3))-

CAS 152477-91-3Formula C18H21NO4Molar mass 321.41 g/molEC 802-927-3
GHS signal word: Warning. Pictograms: Harmful or irritant Prohibited, not for trade
Why it is not for trade
Oxycodone-D6 chemical structure, C18H21NO4, CAS 152477-91-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
152477-91-3
Formula
C18H21NO4
Molar mass
321.41 g/mol
EC number
802-927-3
HS code
284590
Category
Isotope-labelled compounds

What is Oxycodone-D6?

Plain description, key identifiers and synonyms

Oxycodone-D6 is a chemical substance with the molecular formula C18H21NO4 and a molar mass of 321.41 g/mol. Its CAS registry number is 152477-91-3. The IUPAC name is (4R,4aS,7aR,12bS)-4a-hydroxy-9-(trideuteriomethoxy)-3-(trideuteriomethyl)-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(4R,4aS,7aR,12bS)-4a-hydroxy-9-(trideuteriomethoxy)-3-(trideuteriomethyl)-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
CAS number
152477-91-3
EC number
802-927-3
Molecular formula
C18H21NO4
UNII
V2J27K6L44
InChIKey
BRUQQQPBMZOVGD-UKHJWGAOSA-N
InChI
InChI=1S/C18H21NO4/c1-19-8-7-17-14-10-3-4-12(22-2)15(14)23-16(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-/m1/s1/i1D3,2D3
Canonical SMILES
COc1ccc2c3c1OC1C(=O)CCC4(O)C(C2)N(C)CCC314
Isomeric SMILES
[2H]C([2H])([2H])N1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)OC([2H])([2H])[2H])O4)O

Synonyms

  • (3-(Methoxy-d3)-N-(methyl-d3))oxycodone
  • (3-(Methoxy-d3)-N-(methyl-d3))oxycodeinone
  • Oxycodone, (3-(methoxy-d3)-N-(methyl-d3))-
  • (5alpha)-4,5-Epoxy-14-hydroxy-3-(methoxy-d3)-17-(methyl-d3)morphinan-6-one
  • Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-(methoxy-d3)-17-(methyl-d3)-, (5alpha)-
  • (5.Alpha.)-4,5-epoxy-14-hydroxy-3-(methoxy-d3)-17-(methyl-d3)morphinan-6-one
  • Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-(methoxy-d3)-17-(methyl-d3)-, (5.alpha.)-
  • Oxycodone-d6 (CRM)
  • Oxycodone-D6 0.1 mg/ml in Methanol
  • Oxycodone-D6 1.0 mg/ml in Methanol
  • (5Alpha)-4,5-epoxy-14-hydroxy-3-(methoxy-d3)-17-(methyl-d3)-morphinan-6-one

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
321.41 g/molcalc.
Exact mass
321.1847 Dacalc.
LogP (octanol/water)
1.05calc.
Topological polar surface area
59 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
1calc.
Heavy atoms
23calc.
Rings
5calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.61calc.
Formal charge
0calc.
Stereocentres
4calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1CCC2C3Cc4cccc5c4C2(CCN3)C1O5

O=C1CCC2C3Cc4cccc5c4C2(CCN3)C1O5

5 rings, 19 atoms.

148 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H302Harmful if swallowed.
Precautionary statements (5)
  • P264Wash skin thoroughly after handling.
  • P270Do not eat, drink or smoke when using this product.
  • P301 + P317If swallowed: Get medical help.
  • P330Rinse mouth.
  • P501Dispose of contents and container in accordance with local regulations.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Full safety data and first aid

Oxycodone-D6 suppliers

Trading restrictions apply to this substance

Narcotic drug

Oxycodone-D6 is prohibited on CompoundList. Listings, quotes and messages are disabled. This page is kept for information only.

Listing and enquiries are not allowed for this substance.

Reference: UN Single Convention on Narcotic Drugs 1961, HS 2022 subheading 2939.11 (opium alkaloids and their derivatives)

Our policy on controlled substances

Oxycodone-D6 price

Indicative price range per kg from live supplier offers

Prices are not shown for prohibited substances.

Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

Narcotic drug

Oxycodone-D6 is prohibited on CompoundList. Listings, quotes and messages are disabled. This page is kept for information only.

Listing and enquiries are not allowed for this substance.

Reference: UN Single Convention on Narcotic Drugs 1961, HS 2022 subheading 2939.11 (opium alkaloids and their derivatives)

Our policy on controlled substances

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Oxycodone-D6 is traded under.

HS 2845.90Indicative HS code

Compounds, inorganic or organic, of such isotopes, whether or not chemically defined

World exports in 2024
$2.67B
+19.0% vs 2023, imports $1.67B
2019 to 2024
Top exporters
  1. Ireland55.3%
  2. Hong Kong11.8%
  3. United States10.7%
Top importers
  1. China24.3%
  2. Ireland21.9%
  3. South Korea13.3%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Oxycodone-D6 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Oxycodone-D6, based on the data on this page

What is Oxycodone-D6?

Oxycodone-D6 is a chemical substance with the molecular formula C18H21NO4 and a molar mass of 321.41 g/mol. Its CAS registry number is 152477-91-3. The IUPAC name is (4R,4aS,7aR,12bS)-4a-hydroxy-9-(trideuteriomethoxy)-3-(trideuteriomethyl)-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one.

What is the CAS number of Oxycodone-D6?

The CAS registry number of Oxycodone-D6 is 152477-91-3.

What is the molecular formula and weight of Oxycodone-D6?

The molecular formula of Oxycodone-D6 is C18H21NO4 and its molar mass is 321.41 g/mol.

What is Oxycodone-D6 used for?

Known uses and roles of Oxycodone-D6 include isotope-labelled compounds in research and laboratory.

Is Oxycodone-D6 hazardous?

Oxycodone-D6 carries the GHS signal word "Warning". Main hazards: harmful if swallowed. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Oxycodone-D6?

Oxycodone-D6 is usually classified under HS code 284590 (Isotopes other than those of heading 2844, compounds, inorganic or organic, of such…). This is indicative, confirm it with your customs broker before shipping.

Can I buy Oxycodone-D6 on CompoundList?

No. Oxycodone-D6 is on our prohibited list, so listings, quotes and messages for it are disabled. This page is kept for information only.

Guides for buyers

Practical guides that help when you source, ship or handle Oxycodone-D6

Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page

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