287111-41-5
Product Name:
SODIUM 4-METHYLVALERATE-1-13C
Formula:
C6H11NaO2
Synonyms:
4-Methylpentanoic acid-1-13C sodium salt;Sodium isocaproate-1-13C
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COMPUTED DESCRIPTORS
| Molecular Weight | 139.13 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 139.06902871 g/mol |
| Monoisotopic Mass | 139.06902871 g/mol |
| Topological Polar Surface Area | 40.1 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 81.1 |
| Isotope Atom Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |