1-(2,4-Dihydroxy-3,5-diiodophenyl)ethanone
Basic information
- CAS
62069-34-5- Standard SMILES
CC(=O)c1cc(I)c(O)c(I)c1O- InChIKey
WZJYEVYUERSTQF-UHFFFAOYSA-N- Molecular formula
- C8H6I2O3
- Average molar mass
- 403.94 g/mol
- Monoisotopic mass
- 403.84064
Names & identifiers
- Preferred name
- 1-(2,4-Dihydroxy-3,5-diiodophenyl)ethanone
- IUPAC
- 1-(2,4-dihydroxy-3,5-diiodophenyl)ethanone
Names & synonyms
1-(2,4-dihydroxy-3,5-diiodophenyl)ethanone62069-34-5DTXSID80392935RefChem:222856DTXCID903437961-(2,4-dihydroxy-3,5-diiodophenyl)ethan-1-one1-acetyl-2,4-dihydroxy-3,5-diiodobenzeneSCHEMBL22991359STL168828AKOS001577695ST45137164SR-01000078643
Show more names
SR-01000078643-1
Database identifiers
- CAS
62069-34-5- PubChem CID
- 3485906
- DTXSID
DTXSID80392935- Nikkaji
- J3.033.291A
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 210
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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