Basic information
- CAS
1290145-64-0- Standard SMILES
COC(=O)CCB(O)O- InChIKey
LKPSOTQNJGGQSV-UHFFFAOYSA-N- Molecular formula
- C4H9BO4
- Average molar mass
- 131.93 g/mol
- Monoisotopic mass
- 132.0593889
Names & identifiers
- Preferred name
- (3-Methoxy-3-oxopropyl)boronic acid
- IUPAC
- (3-methoxy-3-oxopropyl)boronic acid
Names & synonyms
(3-methoxy-3-oxopropyl)boronic acid1290145-64-0SCHEMBL13091627DTXSID60693154EN300-1180000
Database identifiers
- CAS
1290145-64-0- PubChem CID
- 53255331
- DTXSID
DTXSID60693154
Properties
Computed structural properties
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 92.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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