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Sempervirine Nitrate
[CAS# 5436-46-4]

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Identification
Name Sempervirine Nitrate
Synonyms Sempervirine, Nitrate, Dihydrate; Sempervirine, Nitrate; Sempervirine Nitrate
Molecular Structure CAS#: 5436-46-4, Sempervirine Nitrate
Molecular Formula C19H17N3O3
Molecular Weight 335.36
CAS Registry Number 5436-46-4
SMILES C5=CC4=NC3=C1[N](C=C2C(=C1)CCCC2)C=CC3=C4C=C5.O=[N+](O)[O-]
InChI 1S/C19H16N2.HNO3/c1-2-6-14-12-21-10-9-16-15-7-3-4-8-17(15)20-19(16)18(21)11-13(14)5-1;2-1(3)4/h3-4,7-12H,1-2,5-6H2;(H,2,3,4)
InChIKey IECUCQNAZVURGY-UHFFFAOYSA-N
Properties
Boiling point 591.6°C at 760 mmHg (Cal.)
Flash point 311.6°C (Cal.)
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