4-Chloro-2-fluoro-3-methoxybenzonitrile
Basic information
- CAS
1126320-68-0- Standard SMILES
COc1c(Cl)ccc(C#N)c1F- InChIKey
UKAFKFNOOLUFSX-UHFFFAOYSA-N- Molecular formula
- C8H5ClFNO
- Average molar mass
- 185.58 g/mol
Names & identifiers
- Preferred name
- 4-Chloro-2-fluoro-3-methoxybenzonitrile
- IUPAC
- 4-chloro-2-fluoro-3-methoxybenzonitrile
- English name
- 2-Fluoro-3-methoxy benzonitrile
- Molecular formula
- C8H5ClFNO
- Molecular weight
- 185.58
Names & synonyms
4-chloro-2-fluoro-3-methoxybenzonitrile1126320-68-0MFCD19687208SCHEMBL120437UKAFKFNOOLUFSX-UHFFFAOYSA-NAKOS015957135JS-49854-chloro-2-fluoro-3-methoxy-benzonitrileBenzonitrile, 4-chloro-2-fluoro-3-methoxy-CS-0316659H68107F343237
Show more names
2-FLUORO-3-METHOXY BENZONITRILE
Database identifiers
- CAS
1126320-68-0
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 33 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- form
- Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H302+H312+H332-H315
- Precautionary statements
- 280 · P280-P301+P312-P302+P352
- HS Code
- 2926907090 · 2926907090
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
- 2926907090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H302+H312+H332-H315
- Precautionary statements
- P280-P301+P312-P302+P352
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Related reactions
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Compound notes
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