71370-42-8
Product Name:
[(1-METHYL-1H-IMIDAZOL-2-YL)SULFANYL]ACETIC ACID
Formula:
C6H8N2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 172.21 g/mol |
|---|---|
| XLogP3 | 0.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 172.03064868 g/mol |
| Monoisotopic Mass | 172.03064868 g/mol |
| Topological Polar Surface Area | 80.4 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 154 |
| 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 |