268219-99-4
Product Name:
3-(4-METHOXY-BENZYLSULFANYL)-3-METHYL-BUTYRIC ACID
Formula:
C13H18O3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 254.35 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 254.09766561 g/mol |
| Monoisotopic Mass | 254.09766561 g/mol |
| Topological Polar Surface Area | 71.8 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 245 |
| 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 |