9H-xanthene-1,3,6,8-tetrol
Basic information
- CAS
27393-39-1- Standard SMILES
Oc1cc(O)c2c(c1)Oc1cc(O)cc(O)c1C2- InChIKey
WRWDLBILCDUPOS-UHFFFAOYSA-N- Molecular formula
- C13H10O5
- Average molar mass
- 246.21 g/mol
- Monoisotopic mass
- 246.05282342
Names & identifiers
- Preferred name
- 9H-xanthene-1,3,6,8-tetrol
- IUPAC
- 9H-xanthene-1,3,6,8-tetrol
Names & synonyms
9H-xanthene-1,3,6,8-tetrol27393-39-1DTXSID40319749RefChem:313790DTXCID502708729H-Xanthene-1,3,6,8-tetraolNSC350081NSC-350081
Database identifiers
- CAS
27393-39-1- PubChem CID
- 336323
- DTXSID
DTXSID40319749
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 90.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 282
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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