827607-30-7
Product Name:
3,8-Dioxatricyclo[3.2.1.02,4]octane-6-carboxylic acid, methyl ester (9CI)
Formula:
C8H10O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 170.16 g/mol |
|---|---|
| XLogP3 | -0.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 170.05790880 g/mol |
| Monoisotopic Mass | 170.05790880 g/mol |
| Topological Polar Surface Area | 48.1 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 239 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 5 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |