18522-32-2
Product Name:
Thiocyanic acid, 6-amino-7-benzothiazolyl ester (8CI,9CI)
Formula:
C8H5N3S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 207.3 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 206.99248952 g/mol |
| Monoisotopic Mass | 206.99248952 g/mol |
| Topological Polar Surface Area | 116 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 237 |
| 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 |