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477852-29-2

477852-29-2 structural image
Product Name: 4-[(2-CHLOROBENZYL)SULFANYL]-3-NITROBENZENECARBALDEHYDE O-METHYLOXIME
Formula: C15H13ClN2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 336.8 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 336.0335411 g/mol
Monoisotopic Mass 336.0335411 g/mol
Topological Polar Surface Area 92.7 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 392
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