80691-81-2
Product Name:
2,5-Diaminothiophene-3,4-dicarboxylic acid diethyl ester
Formula:
C10H14N2O4S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 29.9 [ug/mL] (The mean of the results at pH 7.4) |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 258.30 g/mol |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 258.06742811 g/mol |
| Monoisotopic Mass | 258.06742811 g/mol |
| Topological Polar Surface Area | 133 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 272 |
| 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 |