Basic information
- CAS
1543267-99-7- Standard SMILES
O=Cc1cc(F)c(OCC(=O)O)c(F)c1- InChIKey
WOUCKBJUDJOMJO-UHFFFAOYSA-N- Molecular formula
- C9H6F2O4
- Average molar mass
- 216.14 g/mol
- Monoisotopic mass
- 216.02341499
Names & identifiers
- Preferred name
- 2-(2,6-Difluoro-4-formylphenoxy)acetic acid
- IUPAC
- 2-(2,6-difluoro-4-formylphenoxy)acetic acid
Names & synonyms
2-(2,6-difluoro-4-formylphenoxy)acetic acid1543267-99-7AKOS018451195
Database identifiers
- CAS
1543267-99-7- PubChem CID
- 79891753
- EC Number
- 190-531-5
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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