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Epibuphanisine
[CAS# 468-22-4]

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CAS#: 468-22-4
Product: Epibuphanisine
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Identification
Name Epibuphanisine
Synonyms Buphanisin; Buphanisine; Crinan, 1,2-Didehydro-3-Methoxy-, (3.Alpha.)-
Molecular Structure CAS#: 468-22-4, Epibuphanisine
Molecular Formula C17H19NO3
Molecular Weight 285.34
CAS Registry Number 468-22-4
SMILES [C@]345C1=C(C=C2C(=C1)OCO2)CN([C@@H]3CC(C=C4)OC)CC5
InChI 1S/C17H19NO3/c1-19-12-2-3-17-4-5-18(16(17)7-12)9-11-6-14-15(8-13(11)17)21-10-20-14/h2-3,6,8,12,16H,4-5,7,9-10H2,1H3/t12?,16-,17-/m1/s1
InChIKey HATSAIPBKRRCME-RIJFORKLSA-N
Properties
Density 1.334g/cm3 (Cal.)
Boiling point 417.086°C at 760 mmHg (Cal.)
Flash point 126.988°C (Cal.)
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List of Reports Available for Epibuphanisine
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