Basic information
- CAS
5436-48-6- Standard SMILES
CC(C)OOP(=O)(CC(=O)OCc1ccccc1)OC(C)C- InChIKey
GBYWGPKHDBAARY-UHFFFAOYSA-N- Molecular formula
- C15H23O6P
- Average molar mass
- 330.31 g/mol
- Monoisotopic mass
- 330.12322545
Names & identifiers
- Preferred name
- Benzyl {[(propan-2-yl)oxy][(propan-2-yl)peroxy]phosphoryl}acetate
- IUPAC
- benzyl 2-[propan-2-yloxy(propan-2-ylperoxy)phosphoryl]acetate
Names & synonyms
5436-48-6NSC21732DTXSID70281445Benzyl {[(propan-2-yl)oxy][(propan-2-yl)peroxy]phosphoryl}acetateNSC-21732
Database identifiers
- CAS
5436-48-6- PubChem CID
- 228643
- DTXSID
DTXSID70281445
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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