298215-45-9
Product Name:
4-(1,3-DITHIOLAN-2-YL)-2-METHOXY-6-NITROPHENYL 2-CHLOROBENZENECARBOXYLATE
Formula:
C17H14ClNO5S2
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COMPUTED DESCRIPTORS
Molecular Weight | 411.9 g/mol |
---|---|
XLogP3 | 4.8 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 5 |
Exact Mass | 411.0001926 g/mol |
Monoisotopic Mass | 411.0001926 g/mol |
Topological Polar Surface Area | 132 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 514 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |