193338-30-6
Product Name:
(2R,3S)-1-CARBOXY-2,3-DIHYDROXY-4-METHYLCYCLOHEXA-4,6-DIENE, 95
Formula:
C8H10O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 170.16 g/mol |
|---|---|
| XLogP3 | -0.3 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 170.05790880 g/mol |
| Monoisotopic Mass | 170.05790880 g/mol |
| Topological Polar Surface Area | 77.8 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 264 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |