17-BROMOFESTUCLAVINE
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17-BROMOFESTUCLAVINE
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CAS No:
52517-34-7
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Formula:
C16H19BrN2
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Chemical Name:
17-BROMOFESTUCLAVINE
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Synonyms:
17-Bromofestuclavine;CCRIS 6645;(8-beta)-8-(Bromomethyl)-6-methylergoline;Ergoline, 8-(bromomethyl)-6-methyl-, (8-beta)-;UNII-UR16772D9U;UR16772D9U;DTXSID00966955;8-(Bromomethyl)-6-methylergoline;LS-64316;Ergoline, 8-(bromomethyl)-6-methyl-, (8beta)
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CAS No:
Computed Properties
Molecular Weight:319.24
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:318.07316
Monoisotopic Mass:318.07316
Topological Polar Surface Area:19
Heavy Atom Count:19
Complexity:348
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes