4-(Fluoromethyl)pyridine
Basic information
- CAS
82878-59-9- Standard SMILES
FCc1ccncc1- InChIKey
PXJHVEMRKKQTNS-UHFFFAOYSA-N- Molecular formula
- C6H6FN
- Average molar mass
- 111.12 g/mol
- Monoisotopic mass
- 111.04842736
Names & identifiers
- Preferred name
- 4-(Fluoromethyl)pyridine
- IUPAC
- 4-(fluoromethyl)pyridine
- English name
- 4-Fluoromethyl-pyridine
- Molecular formula
- C6H6FN
- Molecular weight
- 111.12
Names & synonyms
4-(fluoromethyl)pyridine82878-59-94-fluoromethylpyridine4-FLUOROMETHYL-PYRIDINEpyridine, 4-(fluoromethyl)-MFCD087060674-(fluoro-methyl)-pyridineSCHEMBL595771SCHEMBL2597340SCHEMBL6630607DTXSID00349067AKOS006288089
Show more names
SB54629AS-40437DA-02553SY242770CS-0084824F461524InChI=1/C6H6FN/c7-5-6-1-3-8-4-2-6/h1-4H,5H
Database identifiers
- CAS
82878-59-9- PubChem CID
- 642806
- DTXSID
DTXSID00349067- Nikkaji
- J443.551F
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 59.5
Experimental & physicochemical properties
SpringerMaterials Properties19F nuclear magnetic resonance spectrum
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H302+H312+H332-H315
- Precautionary statements
- 301 · P301+P312-P302+P352-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
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
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H302+H312+H332-H315
- Precautionary statements
- P301+P312-P302+P352-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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