Basic information
- CAS
4752-98-1- Standard SMILES
CCOc1ccn(C2OC(COC(=O)C(Cl)(Cl)Cl)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)c(=O)n1- InChIKey
COGHLCVBHNKOOK-UHFFFAOYSA-N- Molecular formula
- C20H23Cl3N2O11
- Average molar mass
- 573.8 g/mol
- Monoisotopic mass
- 572.036743
Names & identifiers
- Preferred name
- [3,4,5-Triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methyl 2,2,2-trichloroacetate
- IUPAC
- [3,4,5-triacetyloxy-6-(4-ethoxy-2-oxopyrimidin-1-yl)oxan-2-yl]methyl 2,2,2-trichloroacetate
Names & synonyms
NSC4092534752-98-1DTXSID10325211NSC-4092534-Ethoxy-1-[2,3,4-tri-O-acetyl-6-O-(trichloroacetyl)hexopyranosyl]pyrimidin-2(1H)-one
Database identifiers
- CAS
4752-98-1- PubChem CID
- 349484
- DTXSID
DTXSID10325211
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 12
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 950
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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