CompoundList
Sign in
Screening compounds

Codeine diethylbarbiturate

CAS 6191-40-8Formula C26H33N3O6Molar mass 483.57 g/mol
Get quotes Safety data
Codeine diethylbarbiturate chemical structure, C26H33N3O6, CAS 6191-40-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
6191-40-8
Formula
C26H33N3O6
Molar mass
483.57 g/mol
HS code
293499
Category
Screening compounds

What is Codeine diethylbarbiturate?

Plain description, key identifiers and synonyms

Codeine diethylbarbiturate is a chemical substance with the molecular formula C26H33N3O6 and a molar mass of 483.57 g/mol. Its CAS registry number is 6191-40-8. The IUPAC name is (4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol, 5,5-diethyl-1,3-diazinane-2,4,6-trione.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol, 5,5-diethyl-1,3-diazinane-2,4,6-trione
CAS number
6191-40-8
Molecular formula
C26H33N3O6
UNII
3J0N0W23HR
InChIKey
PCRHVEUKSOYQEE-FFHNEAJVSA-N
InChI
InChI=1S/C18H21NO3.C8H12N2O3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19;1-3-8(4-2)5(11)9-7(13)10-6(8)12/h3-6,11-13,17,20H,7-9H2,1-2H3;3-4H2,1-2H3,(H2,9,10,11,12,13)/t11-,12+,13-,17-,18-;/m0./s1
Canonical SMILES
CCC1(CC)C(=O)NC(=O)NC1=O.COc1ccc2c3c1OC1C(O)C=CC4C(C2)N(C)CCC341
Isomeric SMILES
CCC1(C(=O)NC(=O)NC1=O)CC.CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O

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
483.57 g/molcalc.
Exact mass
483.2369 Dacalc.
LogP (octanol/water)
1.66calc.
Topological polar surface area
117.2 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
7calc.
Rotatable bonds
3calc.
Heavy atoms
35calc.
Rings
6calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.58calc.
Formal charge
0calc.
Stereocentres
5calc.
Components
2calc.
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, C1=CC2C3Cc4cccc5c4C2(CCN3)C(C1)O5

C1=CC2C3Cc4cccc5c4C2(CCN3)C(C1)O5

5 rings, 18 atoms.

246 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

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

Codeine diethylbarbiturate suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

No supplier listings yet

Post one free request and suppliers who make or trade Codeine diethylbarbiturate can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

Codeine diethylbarbiturate price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

Get latest price

Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Codeine diethylbarbiturate is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Codeine diethylbarbiturate, based on the data on this page

What is Codeine diethylbarbiturate?

Codeine diethylbarbiturate is a chemical substance with the molecular formula C26H33N3O6 and a molar mass of 483.57 g/mol. Its CAS registry number is 6191-40-8.

What is the CAS number of Codeine diethylbarbiturate?

The CAS registry number of Codeine diethylbarbiturate is 6191-40-8.

What is the molecular formula and weight of Codeine diethylbarbiturate?

The molecular formula of Codeine diethylbarbiturate is C26H33N3O6 and its molar mass is 483.57 g/mol.

What is Codeine diethylbarbiturate used for?

Known uses and roles of Codeine diethylbarbiturate include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Codeine diethylbarbiturate hazardous?

No GHS hazard classification for Codeine diethylbarbiturate is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Codeine diethylbarbiturate?

Codeine diethylbarbiturate is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Codeine diethylbarbiturate?

Post a free request on CompoundList and suppliers of Codeine diethylbarbiturate will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Codeine diethylbarbiturate?

Suppliers quote Codeine diethylbarbiturate on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Codeine diethylbarbiturate

Get quotes for Codeine diethylbarbiturate

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Codeine diethylbarbiturate
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of Codeine diethylbarbiturate with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/codeine-diethylbarbiturate-6191-40-8" title="Codeine diethylbarbiturate structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Screening compounds or HS code 293499

Price on request
Free quotes, contact stays private
Get quotes