331460-16-3
Product Name:
(6-NITRO-1,3-BENZODIOXOL-5-YL)METHYL 2-(2,5-CYCLOHEXADIENYLIDEN)ACETATE
Formula:
C16H13NO6
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 315.28 g/mol |
---|---|
XLogP3 | 2.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 315.07428713 g/mol |
Monoisotopic Mass | 315.07428713 g/mol |
Topological Polar Surface Area | 90.6 Ų |
Heavy Atom Count | 23 |
Formal Charge | 0 |
Complexity | 547 |
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 |