(2-Butoxy-1,3,2-dioxaborolan-4-YL)methyl octadecanoate
Basic information
- CAS
141135-31-1- Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC1COB(OCCCC)O1- InChIKey
KULAQMLNOQNLSE-UHFFFAOYSA-N- Molecular formula
- C25H49BO5
- Average molar mass
- 440.5 g/mol
- Monoisotopic mass
- 440.3673048
Names & identifiers
- Preferred name
- (2-Butoxy-1,3,2-dioxaborolan-4-YL)methyl octadecanoate
- IUPAC
- (2-butoxy-1,3,2-dioxaborolan-4-yl)methyl octadecanoate
Names & synonyms
141135-31-1(2-BUTOXY-1,3,2-DIOXABOROLAN-4-YL)METHYL OCTADECANOATEDTXSID80770113
Database identifiers
- CAS
141135-31-1- PubChem CID
- 71343532
- DTXSID
DTXSID80770113
Properties
Computed structural properties
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 23
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 407
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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