71077-14-0
Product Name:
1H-Pyrazole-3-carboxylic acid, 4,5-dihydro-5-oxo-1-(4-sulfophenyl)-4-[(4-sulfophenyl)azo]-, reaction products with guanidine hydrochloride N,N'-bis(mixed Ph, tolyl and xylyl) derivs.
Formula:
C17H18ClN7O9S2
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Chemical Classes | UVCB |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 564.0 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 7 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 6 |
| Exact Mass | 563.0295952 g/mol |
| Monoisotopic Mass | 563.0295952 g/mol |
| Topological Polar Surface Area | 296 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 1010 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 3 |
| Compound Is Canonicalized | Yes |