2-Fluoro-6-methoxypyridine
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Basic information
- CAS
116241-61-3- Standard SMILES
COc1cccc(F)n1- InChIKey
PKZOFECOOLMHMG-UHFFFAOYSA-N- Molecular formula
- C6H6FNO
- Average molar mass
- 127.12 g/mol
- Monoisotopic mass
- 127.04334198
Names & identifiers
- Preferred name
- 2-Fluoro-6-methoxypyridine
- IUPAC
- 2-fluoro-6-methoxypyridine
- English name
- Pyridine, 2-fluoro-6-methoxy- (9CI)
- Molecular formula
- C6H6FNO
- Molecular weight
- 127.12
Names & synonyms
2-Fluoro-6-methoxypyridine116241-61-3DTXSID40558611RefChem:261039DTXCID10509392680-704-8PYRIDINE, 2-FLUORO-6-METHOXY-MFCD09998161Pyridine, 2-fluoro-6-methoxy- (9CI)2-fluoro-6-methoxy-pyridineSCHEMBL6792102SCHEMBL17529634
Show more names
2-methoxy-6-fluoropyridine2-Fluoro-6-methoxypyridine, 97
SCHEMBL18300146SCHEMBL28607262SCHEMBL30656311SBB085671AKOS005256762AB55818CS-W000805GS-6439
Database identifiers
- CAS
116241-61-3- PubChem CID
- 14296367
- DTXSID
DTXSID40558611- EC Number
- 680-704-8
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 89.1
Physicochemical properties
- Boiling point
- 141.3 · 141.3±20.0 °C(Predicted)
- Density
- 1.146 · 1.146±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- -2.26 · -2.26±0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- InChI
- InChI=1S/C6H6FNO/c1-9-6-4-2-3-5(7)8-6/h2-4H,1H3
- InChIKey
- PKZOFECOOLMHMG-UHFFFAOYSA-N
- SMILES
- C1(F)=NC(OC)=CC=C1
- CAS DataBase Reference
- 116241 · 116241-61-3
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Danger
- Hazard statements
- 226 · H226-H315-H319-H335
- Precautionary statements
- 261 · P261-P280g-P305+P351+P338
- Hazard Codes
- T
- RIDADR
- 1993 · 1993
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- ridadr
- 1993
- hs_code
- 2933399990
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- T
- hazard_class
- 3
- packing_group
- Ⅲ
- Hazard statements
- H226-H315-H319-H335
- Precautionary statements
- P261-P280g-P305+P351+P338
Chemistry & industry
Applications
UsesPyridine compounds possess a wide range of biological activities, and many varieties of pyridine compounds are used in pesticides and pharmaceuticals. Research on the biological activities of substituted pyridine compounds has aroused great interest among scientists, and related reports are emerging one after another. Among them, Pyridine, 2-fluoro-6-methoxy- (9CI) can be used as a pharmaceutical synthesis intermediate.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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