HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

2-Fluoro-6-methylpyridine

HCID 96090
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
407-22-7
Standard SMILES
Cc1cccc(F)n1
InChIKey
UDMNVTJFUISBFD-UHFFFAOYSA-N
Molecular formula
C6H6FN
Average molar mass
111.12 g/mol
Monoisotopic mass
111.04842741

Names & identifiers

Preferred name
2-Fluoro-6-methylpyridine
IUPAC
2-fluoro-6-methylpyridine
English name
2-Fluoro-6-methylpyridine
Molecular formula
C6H6FN
Molecular weight
111.12

Names & synonyms

2-Fluoro-6-methylpyridine407-22-7Pyridine, 2-fluoro-6-methyl-EINECS 206-980-8DTXSID50193673NSC 51590RefChem:87121DTXCID90116164206-980-8UDMNVTJFUISBFD-UHFFFAOYSA-N2-fluoro-6-picoline6-Fluoro-2-picoline
Show more names
6-me6-methyl-2-fluoropyridine2-Fluoro-6-methylpyridine98%2-Fluoro-6-methylpyridine>2-FLUORO-6-METHYLPYRIDINE 98%2-Bromo-3-methyl-6-nitropyridine
2-fluoro-6-methyl-pyridineMFCD000412262-methyl-6-fluoro-pyridineAB01860PS-9256SY014114EN300-865496-fluoro-2-methylpyridine

Database identifiers

CAS
407-22-7
PubChem CID
96090
DTXSID
DTXSID50193673
EC Number
206-980-8
Nikkaji
J213.666J

Properties

Computed structural propertiesFilling in

XLogP
1.2
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
140 · 140-141 °C (lit.)
Density
1.077 g/mL · 1.077 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.47(lit.)
Flash point
152 °F · 152 °F
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
form
clear liquid
pka
0.29 · 0.29±0.10(Predicted)
color
Colorless to Light orange to Yellow
Specific Gravity
1.07 · 1.07
BRN
107084 · 107084
InChI
1S/C6H6FN/c1-5-3-2-4-6(7)8-5/h2-4H,1H3
InChIKey
UDMNVTJFUISBFD-UHFFFAOYSA-N
SMILES
Cc1cccc(F)n1
CAS DataBase Reference
407 · 407-22-7(CAS DataBase Reference)
NIST Chemistry Reference
2 · 2-Fluoro-6-methylpyridine(407-22-7)

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 · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 50 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
1993
hs_code
2933399090
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi,F
hazard_note
Flammable/Irritant
safety_code
26-36
hazard_class
IRRITANT
Storage Class
10 - Combustible liquids
target organs
Respiratory system
Hazard statements
H315-H319-H335
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemistry & industry

Applications · 2 items

Uses2-Fluoro-6-methylpyridine may be used in the preparation of:2-fluoro-6-pyridinecarboxylic acid2,2′-[1-(6-methylpyridin-2-yl)ethane-1,1-diyl]dipyridine2-fluoropyridine-6-aldoxime2-fluoro-6-(dibromomethyl)pyridine

General Description2-Fluoro-6-methylpyridine, also known as 2-fluoro-6-picoline, can be prepared via diazotization of 2-amino-6-methylpyridine in hydrogen fluoride containing 40% pyridine solution. The effect of substituents on spectral properties of 2-fluoro-6-methylpyridine has been investigated based on 13C NMR, UV and IR spectral data.

Upstream & downstream products

Upstream raw materials

2-Amino-6-methylpyridineSodium nitriteFluoroboric acid

Downstream products

2-Fluoro-6-formylpyridine

Related reactions

59 records
New reaction record
HRID 53217 reaction equation
HRID 53217As reactantuspto-grants-1997_04
HRID 63625 reaction equation
HRID 63625As reactantuspto-grants-2016_09
HRID 77495 reaction equation
HRID 77495As reactantuspto-grants-2014_09
HRID 77804 reaction equation
HRID 77804As reactantuspto-grants-2014_09
HRID 83113 reaction equation
HRID 83113As reactantuspto-grants-2014_09
HRID 102373 reaction equation
HRID 102373As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 113931 reaction equation
HRID 113931As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 118297 reaction equation
HRID 118297As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
Page 1 of 8

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes
Comptox DTXSID
50193673 · DTXSID50193673
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs
Respiratory system
PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes
Xi,F
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
RIDADR
1993 · 1993
WGK Germany
3 · 3
Hazard Note
Flammable/Irritant
HazardClass
IRRITANT
HS Code
2933399090 · 2933399090
Storage Class
10 · 10 - Combustible liquids
Hazard Classifications
2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements
P261-P264-P271-P280-P302+P352-P305+P351+P338