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1393654-69-7

1393654-69-7 structural image
Product Name: HOMOCYSTEINE, N-[[4-(1,1-DIMETHYLETHYL)PHENYL]SULFONYL]-S-METHYL-
Formula: C15H23NO4S2
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COMPUTED DESCRIPTORS

Molecular Weight 345.5 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 8
Exact Mass 345.10685056 g/mol
Monoisotopic Mass 345.10685056 g/mol
Topological Polar Surface Area 117 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 457
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