1325714-73-5
Product Name:
Hexanethioic acid S-(2-acetylamino-ethyl)-ester 2,2,3,3,4,4,5,5,6,6,6-d11
Formula:
C10H8D11NO2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 228.40 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 8 |
| Exact Mass | 228.18269423 g/mol |
| Monoisotopic Mass | 228.18269423 g/mol |
| Topological Polar Surface Area | 71.5 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 183 |
| Isotope Atom Count | 11 |
| 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 |