2,3,4,5-Tetra-O-acetylpentonic acid
Basic information
- CAS
3770-74-9- Standard SMILES
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(=O)O- InChIKey
BQGDMTJDXUMPOE-UHFFFAOYSA-N- Molecular formula
- C13H18O10
- Average molar mass
- 334.28 g/mol
- Monoisotopic mass
- 334.08999677
Names & identifiers
- Preferred name
- 2,3,4,5-Tetra-O-acetylpentonic acid
- IUPAC
- 2,3,4,5-tetraacetyloxypentanoic acid
Names & synonyms
3770-74-9NSC405832,3,4,5-Tetra-O-acetylpentonic acid4233-68-5DTXSID10958740NSC17162NSC82039NSC-17162NSC-40583NSC-82039
Database identifiers
- CAS
3770-74-9、4233-68-5- PubChem CID
- 226565
- DTXSID
DTXSID10958740
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 12
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 483
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Compound notes
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