Codeine N-oxide
Also known as Codeigene, Genocodeine, Gencodeine
Key facts
What buyers check first
- CAS number
- 3688-65-1
- Formula
- C18H21NO4
- Molar mass
- 315.37 g/mol
- EC number
- 222-988-4
- HS code
- 293499
- Category
- Impurities and reference standards
What is Codeine N-oxide?
Plain description, key identifiers and synonyms
Codeine-N-Oxide is a DEA Schedule I controlled substance. Substances in the DEA Schedule I have no currently accepted medical use in the United States, a lack of accepted safety for use under medical supervision, and a high potential for abuse. It is a Opium derivatives substance.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-3-oxido-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-ol
- CAS number
- 3688-65-1 CAS number cross-checked
- EC number
- 222-988-4
- Molecular formula
- C18H21NO4
- UNII
- Z32OFX7V17
- InChIKey
- BDLSDHWCOJPHIE-YMVRPXFZSA-N
- InChI
- InChI=1S/C18H21NO4/c1-19(21)8-7-18-11-4-5-13(20)17(18)23-16-14(22-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-13,17,20H,7-9H2,1-2H3/t11-,12+,13-,17-,18-,19?/m0/s1
- Canonical SMILES
- COc1ccc2c3c1OC1C(O)C=CC4C(C2)[N+](C)([O-])CCC341
- Isomeric SMILES
- C[N+]1(CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O)[O-]
Synonyms
- Codeigene
- Genocodeine
- Gencodeine
- Genocodein
- Codeine-N-oxide
- DEA No. 9053
- Codeine N-oxide ci
- Codeine monohydrate impurity j
- Codeine phosphate hemihydrate impurity j
- Codeine hydrochloride dihydrate impurity j
- Codeine N-oxide ci (usp-rs)
- Morphinan-6-alpha-ol, 7,8-didehydro-4,5-alpha-epoxy-3-methoxy-17-methyl-, 17-oxide
- Morphinan-6-ol,7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, 17-oxide, (5a,6a)-
- Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, 17-oxide, (5-alpha,6-alpha)-
- Codeine monohydrate impurity j (ep impurity)
- Codeine hydrochloride dihydrate impurity j (ep impurity)
- Codeine phosphate hemihydrate impurity j (ep impurity)
- (1S,4S,5R,13R,14S,17R)-14-hydroxy-10-methoxy-4-methyl-12-oxa-4-azapentacyclo(9.6.1.01,13.0?,1?.0?,1?)octadeca-7(18),8,10,15-tetraen-4-ium-4-olate
- (1S,4S,5R,13R,14S,17R)-14-hydroxy-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.01,13.0?,1?.0?,1?]octadeca-7(18),8,10,15-tetraen-4-ium-4-olate
- Codeine N-Oxide (1 mg/mL in Methanol)
- Codeine impurity 1
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 | 315.37 g/molcalc.Computed value |
|---|---|
| Exact mass | 315.1471 Dacalc.Computed value |
| LogP (octanol/water) | 1.51calc.Computed value |
| Topological polar surface area | 61.75 Ųcalc.Computed value |
| Hydrogen bond donors | 1calc.Computed value |
| Hydrogen bond acceptors | 4calc.Computed value |
| Rotatable bonds | 1calc.Computed value |
| Heavy atoms | 23calc.Computed value |
| Rings | 5calc.Computed value |
| Aromatic rings | 1calc.Computed value |
| Fraction sp3 carbons | 0.56calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 6calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H301Toxic if swallowed.
- H302Harmful if swallowed.
- H317May cause an allergic skin reaction.
- H331Toxic if inhaled.
- H334May cause allergy or asthma symptoms or breathing difficulties if inhaled.
- H361Suspected of damaging fertility or the unborn child.
- H362May cause harm to breast-fed children.
Precautionary statements (26)
- P203Obtain, read and follow all safety instructions before use.
- P233Keep container tightly closed.
- P260Do not breathe dust, fume, gas, mist, vapours or spray.
- P261Avoid breathing dust, fume, gas, mist, vapours or spray.
- P263Avoid contact during pregnancy and while nursing.
- P264Wash skin thoroughly after handling.
- P270Do not eat, drink or smoke when using this product.
- P271Use only outdoors or in a well-ventilated area.
- P272Contaminated work clothing should not be allowed out of the workplace.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P284In case of inadequate ventilation wear respiratory protection.
- P301 + P316If swallowed: Get emergency medical help immediately.
- P301 + P317If swallowed: Get medical help.
- P302 + P352If on skin: Wash with plenty of water.
- P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
- P316Get emergency medical help immediately.
- P318If exposed or concerned, get medical advice.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P333 + P317If skin irritation or rash occurs: Get medical help.
- P342 + P316If experiencing respiratory symptoms: Get emergency medical help immediately.
- P362 + P364Take off contaminated clothing. And wash it before reuse.
- P403Store in a well-ventilated place.
- P403 + P233Store in a well-ventilated place. Keep container tightly closed.
- P405Store locked up.
- 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 aidCodeine N-oxide suppliers
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Codeine N-oxide price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.
Regulatory status
Inventories, regulations and trade controls that list this substance
Controls
- US DEA controlled substance or listed chemical
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Codeine N-oxide is traded under.
Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934
- United States24.5%
- Germany23.1%
- Japan4.5%
The HS code shown for Codeine N-oxide is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Codeine N-oxide, based on the data on this page
What is Codeine N-oxide?
What is the CAS number of Codeine N-oxide?
What is the molecular formula and weight of Codeine N-oxide?
Is Codeine N-oxide hazardous?
What is the HS code of Codeine N-oxide?
Where can I buy Codeine N-oxide?
What is the price of Codeine N-oxide?
Guides for buyers
Practical guides that help when you source, ship or handle Codeine N-oxide
- Article, QualityPharma grades explained: IP vs BP vs USP vs EPWhat the Indian, British, US and European pharmacopoeias are, how their monographs differ, what multi grade claims mean and why a grade alone does not make a product fit for medicines.Read
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
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