[5-Benzoyloxy-2-(iodomethyl)-6-methoxy-3-methylsulfonyloxyoxan-4-yl] benzoate
Basic information
- CAS
30572-00-0- Standard SMILES
COC1OC(CI)C(OS(C)(=O)=O)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1- InChIKey
OZTSDQYEZOXRGJ-UHFFFAOYSA-N- Molecular formula
- C22H23IO9S
- Average molar mass
- 590.4 g/mol
- Monoisotopic mass
- 590.01075
Names & identifiers
- Preferred name
- [5-Benzoyloxy-2-(iodomethyl)-6-methoxy-3-methylsulfonyloxyoxan-4-yl] benzoate
- IUPAC
- [5-benzoyloxy-2-(iodomethyl)-6-methoxy-3-methylsulfonyloxyoxan-4-yl] benzoate
Names & synonyms
30572-00-0NSC179635[5-benzoyloxy-2-(iodomethyl)-6-methoxy-3-methylsulfonyloxyoxan-4-yl] benzoateDTXSID90306745NSC-179635Methyl 2,3-di-O-benzoyl-6-deoxy-6-iodo-4-O-(methanesulfonyl)hexopyranoside
Database identifiers
- CAS
30572-00-0- PubChem CID
- 301616
- DTXSID
DTXSID90306745
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 10
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 756
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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