4-Ethoxy-3,5-difluorobenzoyl chloride
Basic information
- CAS
1017779-21-3- Standard SMILES
CCOc1c(F)cc(C(=O)Cl)cc1F- InChIKey
HOTODZHRJLEUAJ-UHFFFAOYSA-N- Molecular formula
- C9H7ClF2O2
- Average molar mass
- 220.6 g/mol
- Monoisotopic mass
- 220.0102635
Names & identifiers
- Preferred name
- 4-Ethoxy-3,5-difluorobenzoyl chloride
- IUPAC
- 4-ethoxy-3,5-difluorobenzoyl chloride
- English name
- 4-Ethoxy-3,5-difluorobenzoylchloride
- Molecular formula
- C9H7ClF2O2
- Molecular weight
- 220.6
Names & synonyms
4-ethoxy-3,5-difluorobenzoyl chloride1017779-21-3MFCD092586843,5-Difluoro-4-ethoxybenzoyl chlorideDTXSID901286941SBB0960404-ethoxy-3,5-difluorobenzoylchlorideAKOS015956597JS-46864-ethoxy-3,5-difluoro-benzoyl chlorideF342831Benzoyl chloride, 4-ethoxy-3,5-difluoro-
Database identifiers
- CAS
1017779-21-3- PubChem CID
- 46737604
- DTXSID
DTXSID901286941
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 201
Physicochemical properties
- HS Code
- 2916399090 · 2916399090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2916399090
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Related reactions
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Compound notes
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