Basic information
- CAS
29209-41-4- Standard SMILES
CC1OC12C(O)C(O)C(O)C(O)C2O- InChIKey
PSMKXDLIJMWSBB-UHFFFAOYSA-N- Molecular formula
- C8H14O6
- Average molar mass
- 206.19 g/mol
- Monoisotopic mass
- 206.07903816
Names & identifiers
- Preferred name
- 2-Methyl-1-oxaspiro[2.5]octane-4,5,6,7,8-pentol
- IUPAC
- 2-methyl-1-oxaspiro[2.5]octane-4,5,6,7,8-pentol
Names & synonyms
29209-41-42-methyl-1-oxaspiro[2.5]octane-4,5,6,7,8-pentolNSC55549SCHEMBL6671973DTXSID00288386NSC-55549
Database identifiers
- CAS
29209-41-4- PubChem CID
- 244580
- DTXSID
DTXSID00288386
Properties
Computed structural properties
- XLogP
- -3.1
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 228
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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