Morphinan-3-ol, 17-methyl-, carbonate (2:1) (ester), hydrochloride, trichloromethane, hydrate (6:1:9), (9-alpha,13-alpha,14-alpha)-
Basic information
- CAS
38848-18-9- Standard SMILES
CN1CCC23CCCCC2C1Cc1ccc(OC(=O)Oc2ccc4c(c2)C25CCCCC2C(C4)N(C)CC5)cc13.Cl.Cl- InChIKey
APLRPDDVEAIUPO-UHFFFAOYSA-N- Molecular formula
- C35H46Cl2N2O3
- Average molar mass
- 613.7 g/mol
- Monoisotopic mass
- 612.2885487
Names & identifiers
- Preferred name
- Morphinan-3-ol, 17-methyl-, carbonate (2:1) (ester), hydrochloride, trichloromethane, hydrate (6:1:9), (9-alpha,13-alpha,14-alpha)-
- IUPAC
- bis(17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-yl) carbonate;dihydrochloride
Names & synonyms
38848-18-9Morphinan-3-ol, 17-methyl-, carbonate (2:1) (ester), hydrochloride, trichloromethane, hydrate (6:1:9), (9-alpha,13-alpha,14-alpha)-RefChem:1089886d-N,N'-Dimethyl-3,3'-(carbonyldioxy)-dimorphinan hydrochlorideDTXSID70959632Bis(17-methylmorphinan-3-yl) carbonate--hydrogen chloride (1/2)
Database identifiers
- CAS
38848-18-9- PubChem CID
- 217405
- DTXSID
DTXSID70959632
Properties
Computed structural properties
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 898
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…