1104637-53-7
Product Name:
Acetyleneboronic acid MIDA ester, Acetynylboronic acid MIDA ester, Ethyneboronic acid MIDA ester
Formula:
C7H8BNO4
Synonyms:
Acetyleneboronic acid MIDA ester;Acetynylboronic acid MIDA ester;Ethyneboronic acid MIDA ester
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COMPUTED DESCRIPTORS
| Molecular Weight | 180.96 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 181.0546379 g/mol |
| Monoisotopic Mass | 181.0546379 g/mol |
| Topological Polar Surface Area | 55.8 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 262 |
| 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 |