321580-87-4
Product Name:
methyl N-butyl-N-(1,1-dioxothiolan-3-yl)carbamodithioate
Formula:
C10H19NO2S3
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 36.9 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 281.5 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 281.05779237 g/mol |
| Monoisotopic Mass | 281.05779237 g/mol |
| Topological Polar Surface Area | 103 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 335 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |