Cas no 1421-13-2 (Morphinan-3,6-diol,4,5-epoxy-, (5a,6a)-)
1421-13-2 structure
Product Name:Morphinan-3,6-diol,4,5-epoxy-, (5a,6a)-
CAS No:1421-13-2
MF:C16H19NO3
MW:273.326964616776
CID:162247
PubChem ID:3083718
Update Time:2025-04-19
Morphinan-3,6-diol,4,5-epoxy-, (5a,6a)- Chemical and Physical Properties
Names and Identifiers
-
- Morphinan-3,6-diol,4,5-epoxy-, (5a,6a)-
- Dihydro Normorphine
- (4S,4aR,7S,7aR,12bS)-1,2,3,4,4a,5,6,7,7a,13-decahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol
- DihydronorMorphine
- 4,5α-EpoxyMorphinan-3,6α-diol
- (5α,6α)-4,5-EpoxyMorphinan-3,6-diol
- 4,5-Epoxymorphinan-3,6-diol
- Morphinan-3,6-diol, 4,5-epoxy-, (5alpha,6alpha)-
- 1421-13-2
- DTXSID10931336
-
- MDL： MFCD00800343
- Inchi： 1S/C16H19NO3/c18-11-3-1-8-7-10-9-2-4-12(19)15-16(9,5-6-17-10)13(8)14(11)20-15/h1,3,9-10,12,15,17-19H,2,4-7H2/t9-,10-,12-,15-,16-/m0/s1
- InChI Key： HVQUMOKQAJNIKK-WYCAWQEYSA-N
- SMILES： O1C2=C(C=CC3C[C@H]4[C@@H]5CC[C@@H]([C@H]1[C@@]5(C=32)CCN4)O)O
Computed Properties
- Exact Mass: 273.13600
- Monoisotopic Mass: 273.13649347g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 0
- Complexity: 430
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 5
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 61.7?2
Experimental Properties
- PSA: 61.72000
- LogP: 1.40870
Morphinan-3,6-diol,4,5-epoxy-, (5a,6a)- Related Literature
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
-
Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
-
Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
1421-13-2 (Morphinan-3,6-diol,4,5-epoxy-, (5a,6a)-) Related Products
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