Basic information
- CAS
5430-42-2- Standard SMILES
CCOC(=O)CCCc1cc[c]([Sb](=[O])([OH])[OH])cc1- InChIKey
WUZQCDZKZWALNV-UHFFFAOYSA-L- Molecular formula
- C12H17O5Sb
- Average molar mass
- 363.02 g/mol
- Monoisotopic mass
- 362.01141
Names & identifiers
- Preferred name
- [4-(4-Ethoxy-4-oxo-butyl)phenyl]stibonic acid
- IUPAC
- [4-(4-ethoxy-4-oxobutyl)phenyl]stibonic acid
Names & synonyms
NSC137935430-42-2Compound 13793[4-(4-ethoxy-4-oxo-butyl)phenyl]stibonic acidBDBM26622DTXSID80279712NSC-13793NCGC00168356-01Ethyl 4-(4-(dihydroxy(oxido)stibino)phenyl)butanoateethyl 4-{4-[dihydroxy(oxo)-$l^{5}-stibanyl]phenyl}butanoateEthyl 4-{4-[dihydroxy(oxo)-lambda~5~-stibanyl]phenyl}butanoate
Database identifiers
- CAS
5430-42-2- PubChem CID
- 224930
- DTXSID
DTXSID80279712
Properties
Computed structural properties
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 304
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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