[3,4,6-Triacetyloxy-5-(2-chloroethylcarbamoylamino)oxan-2-yl]methyl acetate
Basic information
- CAS
33059-87-9- Standard SMILES
CC(=O)OCC1OC(OC(C)=O)C(NC(=O)NCCCl)C(OC(C)=O)C1OC(C)=O- InChIKey
OTDJIUDZCQWRBE-UHFFFAOYSA-N- Molecular formula
- C17H25ClN2O10
- Average molar mass
- 452.8 g/mol
- Monoisotopic mass
- 452.1197727
Names & identifiers
- Preferred name
- [3,4,6-Triacetyloxy-5-(2-chloroethylcarbamoylamino)oxan-2-yl]methyl acetate
- IUPAC
- [3,4,6-triacetyloxy-5-(2-chloroethylcarbamoylamino)oxan-2-yl]methyl acetate
Names & synonyms
33059-87-9NSC114098DTXSID40954679NSC-1140981,3,4,6-Tetra-O-acetyl-2-({[(2-chloroethyl)imino](hydroxy)methyl}amino)-2-deoxyhexopyranose
Database identifiers
- CAS
33059-87-9- PubChem CID
- 270933
- DTXSID
DTXSID40954679
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 12
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 658
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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