Basic information
- CAS
33985-27-2- Standard SMILES
CC(=O)OC1CC(OC(C)=O)C(OC(C)=O)C(C)O1- InChIKey
QKPIXQGRPBEVLX-UHFFFAOYSA-N- Molecular formula
- C12H18O7
- Average molar mass
- 274.27 g/mol
- Monoisotopic mass
- 274.10525291
Names & identifiers
- Preferred name
- 1,3,4-Tri-O-acetyl-2,6-dideoxyhexopyranose
- IUPAC
- (3,6-diacetyloxy-2-methyloxan-4-yl) acetate
Names & synonyms
33985-27-2NSC2948731,3,4-Tri-O-acetyl-2,6-dideoxyhexopyranoseSCHEMBL13296956DTXSID60955567NSC287064NSC-287064NSC-29487367335-77-7
Database identifiers
- CAS
33985-27-2、67335-77-7- PubChem CID
- 323892
- DTXSID
DTXSID60955567
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 365
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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