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Obamegine
[CAS# 479-37-8]

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CAS#: 479-37-8
Product: Obamegine
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Identification
Name Obamegine
Synonyms Nsc123123; Obamegin
Molecular Structure CAS#: 479-37-8, Obamegine
Molecular Formula C36H38N2O6
Molecular Weight 594.71
CAS Registry Number 479-37-8
SMILES [C@@H]16N(CCC2=C1C(=C(C(=C2)OC)O)OC7=CC3=C(CCN(C)[C@@H]3CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C6)O)C=C7OC)C
InChI 1S/C36H38N2O6/c1-37-13-11-23-18-31(41-3)32-20-26(23)27(37)15-21-5-8-25(9-6-21)43-30-17-22(7-10-29(30)39)16-28-34-24(12-14-38(28)2)19-33(42-4)35(40)36(34)44-32/h5-10,17-20,27-28,39-40H,11-16H2,1-4H3/t27-,28+/m1/s1
InChIKey XGEAUXVPBXUBKN-IZLXSDGUSA-N
Properties
Density 1.239g/cm3 (Cal.)
Boiling point 706.483°C at 760 mmHg (Cal.)
Flash point 381.067°C (Cal.)
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