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241127-19-5

241127-19-5 structural image
Product Name: 2-(TERT-BUTYLSULFONYL)-2-[2-(4-METHOXYPHENYL)HYDRAZONO]ACETONITRILE
Formula: C13H17N3O3S
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COMPUTED DESCRIPTORS

Molecular Weight 295.36 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 295.09906259 g/mol
Monoisotopic Mass 295.09906259 g/mol
Topological Polar Surface Area 99.9 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 497
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes