477863-08-4
Product Name:
4-OXO-5,6,7,8-TETRAHYDRO-4H-1,5,8A-TRIAZA-AZULENE-2-CARBOXYLIC ACID
Formula:
C8H9N3O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 195.18 g/mol |
|---|---|
| XLogP3 | -0.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 195.06439116 g/mol |
| Monoisotopic Mass | 195.06439116 g/mol |
| Topological Polar Surface Area | 84.2 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 269 |
| 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 |