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303996-26-1

303996-26-1 structural image
Product Name: 4-(BENZYLSULFANYL)-3-NITROBENZENECARBALDEHYDE O-(4-NITROBENZYL)OXIME
Formula: C21H17N3O5S
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COMPUTED DESCRIPTORS

Molecular Weight 423.4 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 7
Exact Mass 423.08889182 g/mol
Monoisotopic Mass 423.08889182 g/mol
Topological Polar Surface Area 139 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 580
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes