Cas no 508-54-3 (14-hydroxycodeinone)
14-hydroxycodeinone structure
Product Name:14-hydroxycodeinone
CAS No:508-54-3
MF:C18H19NO4
MW:313.347765207291
CID:839082
PubChem ID:9926820
Update Time:2025-04-19
14-hydroxycodeinone Chemical and Physical Properties
Names and Identifiers
-
- 14-hydroxycodeinone
- 14-hydroxy-codeinone
- 4-(9b-ethyl-5-methoxy-1,2,3,3a,8,9,9a,9b-octahydro-phenanthro[4,5-bcd]furan-3-yl)-morpholine
- Morpholine,4-(9bb-ethyl-1,2,3,3ab,8,9,9ab,9b-octahydro-5-methoxyphenanthro[4,5-bcd]furan-3-yl)-(8CI)
- Morpholine,4-(9b-ethyl-1,2,3,3a,8,9,9a,9b-octahydro-5-methoxyphenanthro[4,5-bcd]furan-3-yl)-,[3S-(3a,3ab,9ab,9bb)]-(9CI)
- Oxycodone impurity D
- EINECS 208-085-8
- MORPHINAN-6-ONE, 7,8-DIDEHYDRO-4,5-EPOXY-14-HYDROXY-3-METHOXY-17-METHYL-, (5-.ALPHA.)-
- (5alpha)-7,8-Didehydro-4,5-epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one
- DTXSID801316557
- 91138F771G
- CODEINONE, 14-HYDROXY-
- 7,8-Didehydro-4,5alpha-epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one (14-Hydroxycodeinone)
- Hydroxycodeinone
- (5.ALPHA.)-7,8-DIDEHYDRO-4,5-EPOXY-14-HYDROXY-3-METHOXY-17-METHYLMORPHINAN-6-ONE
- CODEINE MONOHYDRATE IMPURITY K [EP IMPURITY]
- 14-Hydroxy Codeinone
- Q27271360
- HYDROXYCODEINONE [MI]
- BRN 4552573
- UNII-91138F771G
- Morphinan-6-one, 7,8-didehydro-4,5-epoxy-14-hydroxy-3-methoxy-17-methyl-, (5-alpha)-
- 14.BETA.-HYDROXYCODEINONE
- OXYCODONE HYDROCHLORIDE IMPURITY D [EP IMPURITY]
- SCHEMBL38000
- 508-54-3
- CODEINE HYDROCHLORIDE DIHYDRATE IMPURITY K [EP IMPURITY]
- CODEINE PHOSPHATE HEMIHYDRATE IMPURITY K [EP IMPURITY]
-
- Inchi： 1S/C18H19NO4/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/h3-6,13,16,21H,7-9H2,1-2H3/t13-,16+,17+,18-/m1/s1
- InChI Key： YYCRAERBSFHMPL-XFKAJCMBSA-N
- SMILES： O1C2=C(C=CC3C[C@@H]4[C@@]5(C=CC([C@H]1[C@@]5(C=32)CCN4C)=O)O)OC
Computed Properties
- Exact Mass: 313.13100
- Monoisotopic Mass: 313.13140809g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 23
- Rotatable Bond Count: 1
- Complexity: 592
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.1
- Topological Polar Surface Area: 59?2
Experimental Properties
- Density: 1.2389 (rough estimate)
- Melting Point: 275°C (rough estimate)
- Boiling Point: 453.15°C (rough estimate)
- Refractive Index: 1.5100 (estimate)
- PSA: 59.00000
- LogP: 1.35280
14-hydroxycodeinone Related Literature
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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