331461-13-3
Product Name:
4-(1,3-DITHIOLAN-2-YL)-2-METHOXY-6-NITROPHENYL 4-METHYLBENZENECARBOXYLATE
Formula:
C18H17NO5S2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 391.5 g/mol |
---|---|
XLogP3 | 4.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 5 |
Exact Mass | 391.05481499 g/mol |
Monoisotopic Mass | 391.05481499 g/mol |
Topological Polar Surface Area | 132 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 500 |
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 |