2,4-Heptadione, 7-chloro-6-(chlorodifluoromethyl)-7,7-difluoro-6-hydroxy-
Basic information
- CAS
6203-86-7- Standard SMILES
CC(=O)CC(=O)CC(O)(C(F)(F)Cl)C(F)(F)Cl- InChIKey
IDICRHDPRLGJHQ-UHFFFAOYSA-N- Molecular formula
- C8H8Cl2F4O3
- Average molar mass
- 299.04 g/mol
- Monoisotopic mass
- 297.9786621
Names & identifiers
- Preferred name
- 2,4-Heptadione, 7-chloro-6-(chlorodifluoromethyl)-7,7-difluoro-6-hydroxy-
- IUPAC
- 7-chloro-6-[chloro(difluoro)methyl]-7,7-difluoro-6-hydroxyheptane-2,4-dione
Names & synonyms
BRN 29797572,4-HEPTADIONE, 7-CHLORO-6-(CHLORODIFLUOROMETHYL)-7,7-DIFLUORO-6-HYDROXY-6203-86-7DTXSID202110907-Chloro-7,7-difluoro-6-hydroxy-6-(chlorodifluoromethyl)-2,4-heptadioneRefChem:246730DTXCID201335817-Chloro-6-[chlorodi(fluoro)methyl]-7,7-difluoro-6-hydroxyheptane-2,4-dione
Database identifiers
- CAS
6203-86-7- PubChem CID
- 22577
- DTXSID
DTXSID20211090- Nikkaji
- J73.608B
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 319
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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