Basic information
- Standard SMILES
Cc1ccc(F)nc1- InChIKey
AOSOZARHUJMBLZ-UHFFFAOYSA-N- Molecular formula
- C6H6FN
- Average molar mass
- 111.12 g/mol
- Monoisotopic mass
- 111.04842741
Names & identifiers
- Preferred name
- 2-Fluoro-5-methylpyridine
- IUPAC
- 2-fluoro-5-methylpyridine
- English name
- 2-Fluoro-5-methylpyridine
- Molecular formula
- C6H6FN
- Molecular weight
- 111.12
Names & synonyms
2-Fluoro-5-methylpyridine2369-19-9DTXSID60379143RefChem:87107DTXCID70330169624-867-5AOSOZARHUJMBLZ-UHFFFAOYSA-N2-Fluoro-5-picolinePyridine, 2-fluoro-5-methyl-6-Fluoro-3-picolineMFCD000412252-fluoro-5-methyl-pyridine
Show more names
2-Fluoro-5-muoro-5-methyLFluoromethylpyridine32-FLUORO-5-METHYPYRIDINE2-Bromo-1-methylpyridine2-Fluoro-5-methylpyridine97%2-Fluoro-5-methylpyridine>
5-methyl-2-fluoropyridine6-fluoro-3-methylpyridine2-fluoro-5-methyl pyridineSCHEMBL114511SCHEMBL447044SCHEMBL675543SCHEMBL3056334SCHEMBL4756471
Database identifiers
- CAS
2369-19-9- PubChem CID
- 2774635
- DTXSID
DTXSID60379143- EC Number
- 624-867-5
- Nikkaji
- J594.818E
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 74.9
Physicochemical properties
- Boiling point
- 158 · 158-159 °C (lit.)
- Density
- 1.072 g/mL · 1.072 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.4730(lit.)
- Flash point
- 119 °F · 119 °F
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- -0.14 · -0.14±0.10(Predicted)
- form
- Liquid
- Specific Gravity
- 1.077 · 1.077
- color
- Colorless to pale yellow
- BRN
- 107085 · 107085
- InChI
- InChI=1S/C6H6FN/c1-5-2-3-6(7)8-4-5/h2-4H,1H3
- InChIKey
- AOSOZARHUJMBLZ-UHFFFAOYSA-N
- SMILES
- C1(F)=NC=C(C)C=C1
- CAS DataBase Reference
- 2369 · 2369-19-9(CAS DataBase Reference)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Warning
- Hazard statements
- 226 · H226-H315-H319-H335
- Precautionary statements
- 210 · P210-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi,F
- Risk Statements
- 10 · 10-36/37/38
- Safety Statements
- 16 · 16-26-36/37-36
- RIDADR
- 1993 · UN 1993 3/PG 3
- WGK Germany
- 3 · 3
- Hazard Note
- Flammable/Irritant
- HazardClass
- 3 · 3
- PackingGroup
- III
- HS Code
- 29333990 · 29333990
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 2 Flam · Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
Warning
H226 (97.9%): 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 48 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (97.9%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- ridadr
- UN 1993 3/PG 3
- hs_code
- 29333990
- risk_code
- 10-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- Xi,F
- hazard_note
- Flammable/Irritant
- safety_code
- 16-26-36/37-36
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H226-H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
- Precautionary statements
- P210-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses2-Fluoro-5-methylpyridine serves as a starting material for the preparation of 6-fluoronicotinic acid[6].
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers50 total
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Related reactions
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