8064-60-6
Product Name:
PRIMULINE
Formula:
C21H14N3NaO3S3
Synonyms:
Direct Yellow 59;Primuline Yellow
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COMPUTED DESCRIPTORS
| Molecular Weight | 1040.3 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 18 |
| Rotatable Bond Count | 7 |
| Exact Mass | 1039.0537300 g/mol |
| Monoisotopic Mass | 1039.0537300 g/mol |
| Topological Polar Surface Area | 383 Ų |
| Heavy Atom Count | 69 |
| Formal Charge | 0 |
| Complexity | 1720 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |