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Home >> Chemical Listing >> O >> (4aR,12R)-2,3,4,4abeta,5,6,7,10-Octahydro-1,12-Dimethyl-1H-5beta,10bbeta-Propano-1,7-Phenanthrolin-8(9H)-One

(4aR,12R)-2,3,4,4abeta,5,6,7,10-Octahydro-1,12-Dimethyl-1H-5beta,10bbeta-Propano-1,7-Phenanthrolin-8(9H)-One
[CAS 596-55-4]

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Identification
Name (4aR,12R)-2,3,4,4abeta,5,6,7,10-Octahydro-1,12-Dimethyl-1H-5beta,10bbeta-Propano-1,7-Phenanthrolin-8(9H)-One
Synonyms Alpha-Obscurine
Molecular Structure CAS#: 596-55-4， (4aR,12R)-2,3,4,4abeta,5,6,7,10-Octahydro-1,12-Dimethyl-1H-5beta,10bbeta-Propano-1,7-Phenanthrolin-8(9H)-One
Molecular Formula C17H26N2O
Molecular Weight 274.41
CAS Registry Number 596-55-4
SMILES [C@]234C1=C(NC(CC1)=O)C[C@@H]([C@H]2CCCN3C)C[C@H](C4)C
InChI 1S/C17H26N2O/c1-11-8-12-9-15-14(5-6-16(20)18-15)17(10-11)13(12)4-3-7-19(17)2/h11-13H,3-10H2,1-2H3,(H,18,20)/t11-,12+,13-,17-/m1/s1
InChIKey HXJHQEWSHQXRPH-IPJQOSJUSA-N
Properties
Density 1.144g/cm3 (Cal.)
Boiling point 471.133°C at 760 mmHg (Cal.)
Flash point 238.733°C (Cal.)
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