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1260639-01-7

1260639-01-7 structural image
Product Name: ETHYL 2-(4-FLUORO-PHENYL)-6-BROMO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-1-CARBOXYLATE
Formula: C18H17BrFNO2
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COMPUTED DESCRIPTORS

Molecular Weight 378.2 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 377.04267 g/mol
Monoisotopic Mass 377.04267 g/mol
Topological Polar Surface Area 29.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 414
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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