Morphine monohydrate
Also known as Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl-(5-alpha,6-alpha)-, monohydrate, Morphine hydrate, Morphine.monohydrate
Key facts
What buyers check first
- CAS number
- 6009-81-0
- Formula
- C17H21NO4
- Molar mass
- 303.36 g/mol
- EC number
- 685-600-6
- HS code
- 293499
- Category
- Screening compounds
What is Morphine monohydrate?
Plain description, key identifiers and synonyms
Morphine monohydrate is a chemical substance with the molecular formula C17H21NO4 and a molar mass of 303.36 g/mol. Its CAS registry number is 6009-81-0. The IUPAC name is (4R,4aR,7S,7aR,12bS)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol, hydrate.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (4R,4aR,7S,7aR,12bS)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol, hydrate
- CAS number
- 6009-81-0
- EC number
- 685-600-6
- Molecular formula
- C17H21NO4
- UNII
- 41TQ665R1X
- InChIKey
- IYXRQFVHZFEWSY-VYKNHSEDSA-N
- InChI
- InChI=1S/C17H19NO3.H2O/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18;/h2-5,10-11,13,16,19-20H,6-8H2,1H3;1H2/t10-,11+,13-,16-,17-;/m0./s1
- Canonical SMILES
- CN1CCC23c4c5ccc(O)c4OC2C(O)C=CC3C1C5.O
- Isomeric SMILES
- CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O.O
Synonyms
- Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl-(5-alpha,6-alpha)-, monohydrate
- Morphine hydrate
- Morphine.monohydrate
- (4R,4aR,7S,7aR,12bS)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol, hydrate
- Morphinhydrat
- Morphine base monohydrate
- Morphinum
- Morphine monohydrate cii
- Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5-alpha,6-alpha)-, monohydrate
- Morphine.monohydrate, 1mg/ml in Methanol (as free base)
- Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5-alpha,6-.alpha.)-, monohydrate
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 | 303.36 g/molcalc.Computed value |
|---|---|
| Exact mass | 303.1471 Dacalc.Computed value |
| LogP (octanol/water) | 0.37calc.Computed value |
| Topological polar surface area | 84.43 Ųcalc.Computed value |
| Hydrogen bond donors | 2calc.Computed value |
| Hydrogen bond acceptors | 4calc.Computed value |
| Rotatable bonds | 0calc.Computed value |
| Heavy atoms | 22calc.Computed value |
| Rings | 5calc.Computed value |
| Aromatic rings | 1calc.Computed value |
| Fraction sp3 carbons | 0.53calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 5calc.Computed value |
| Components | 2calc.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
- H302Harmful if swallowed.
- H341Suspected of causing genetic defects.
- H361Suspected of damaging fertility or the unborn child.
- H362May cause harm to breast-fed children.
Precautionary statements (11)
- P203Obtain, read and follow all safety instructions before use.
- P260Do not breathe 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.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P301 + P317If swallowed: Get medical help.
- P318If exposed or concerned, get medical advice.
- P330Rinse mouth.
- 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 aidMorphine monohydrate suppliers
Trading restrictions apply to this substance
Morphine monohydrate is prohibited on CompoundList. Listings, quotes and messages are disabled. This page is kept for information only.
Our policy on controlled substancesMorphine monohydrate 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
Industries and functions
Regulatory status
Inventories, regulations and trade controls that list this substance
Morphine monohydrate is prohibited on CompoundList. Listings, quotes and messages are disabled. This page is kept for information only.
Our policy on controlled substancesHS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Morphine monohydrate 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 Morphine monohydrate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Morphine monohydrate, based on the data on this page
What is Morphine monohydrate?
What is the CAS number of Morphine monohydrate?
What is the molecular formula and weight of Morphine monohydrate?
What is Morphine monohydrate used for?
Is Morphine monohydrate hazardous?
What is the HS code of Morphine monohydrate?
Can I buy Morphine monohydrate on CompoundList?
Guides for buyers
Practical guides that help when you source, ship or handle Morphine monohydrate
- 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
- Guide, Chemical identityCAS registry numbers explainedWhat a CAS number identifies, how the check digit works, why one chemical can have several numbers and what a CAS number cannot tell you about a product.Read
Explore more in Screening compounds or HS code 293499