2-Bromo-6-methylpyridine
Basic information
- CAS
5315-25-3- Standard SMILES
Cc1cccc(Br)n1- InChIKey
SOHDPICLICFSOP-UHFFFAOYSA-N- Molecular formula
- C6H6BrN
- Average molar mass
- 172.02 g/mol
- Monoisotopic mass
- 170.96836129
Names & identifiers
- Preferred name
- 2-Bromo-6-methylpyridine
- IUPAC
- 2-bromo-6-methylpyridine
- English name
- 2-Bromo-6-methylpyridine
- Molecular formula
- C6H6BrN
- Molecular weight
- 172.02
Names & synonyms
2-Bromo-6-methylpyridine5315-25-3Pyridine, 2-bromo-6-methyl-DTXSID70201229EINECS 226-173-4AI3-62420RefChem:85816DTXCID20123720226-173-42-Bromo-6-picoline6-Bromo-2-picoline2-bromo-6-methyl-pyridine
Show more names
2-Bromo-6-methyL6-Bromo-2-picoline,97%2-Brom-6-methylpyridin2-Bromo-6-methylpyrdine2-bormo-6-methylpyridine2-BROMO-6-MEFHYL PYRIDINEBromomethylpyridine,ca.97%
6-bromo-2-methylpyridine2-Bromo-6-Methyl PyridineMFCD000407436-bromopicolineSCHEMBL103431AKOS005255682CS-W002190SY001968
Database identifiers
- CAS
5315-25-3- PubChem CID
- 79205
- DTXSID
DTXSID70201229- EC Number
- 226-173-4
- Nikkaji
- J297.999C
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 74.9
Physicochemical properties
- Boiling point
- 102 · 102-103 °C/20 mmHg (lit.)
- Density
- 1.512 g/mL · 1.512 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.562(lit.)
- Flash point
- 207 °F · 207 °F
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Chloroform, Ethyl Aceate
- form
- Liquid
- pka
- 1.51 · 1.51±0.10(Predicted)
- Specific Gravity
- 1.512 · 1.512
- color
- Clear colorless to yellow
- Water Solubility
- Soluble in chloroform, ethyl aceate. Not miscible or difficult to mix with water.
- BRN
- 107322 · 107322
- InChI
- InChI=1S/C6H6BrN/c1-5-3-2-4-6(7)8-5/h2-4H,1H3
- InChIKey
- SOHDPICLICFSOP-UHFFFAOYSA-N
- SMILES
- C1(Br)=NC(C)=CC=C1
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
H302 (11.8%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (11.8%)
CSL Reaction Information
CSL00076
3-CHLOROPEROXYBENZOIC ACID + 2-BROMO-6-METHYLPYRIDINE
exploded on the rotovap after work up
Explosive
User-Reported
7/8/18
Safety data
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- hs_code
- 29333990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- hazard_class
- IRRITANT
- Storage Class
- 10 - Combustible liquids
- target organs
- Respiratory system
Chemistry & industry
Applications
Uses2-Bromo-6-methylpyridine may be used in the synthesis of the following:6,6′-dimethyl-2,2′-bipyridine6-methyl-2-pyridyl-2-pyridylmethanone2-methyl-6-(trimethylsilyl)-pyridineN,N′-bis-(6-methylpyrid-2-yl)-(1R,2R)-1,2- diaminocyclohexane (cydiampy)2-methyl-6-(trimethylstannanyl)pyridine2-(6-methylpyridin-2-yl)propan-2-olbis[(2-bromo-6-methylpyridinium)hexafluorosilicate] monohydrate
Uses2-Bromo-6-methylpyridine is a halogenated pyridine derivative used is a building block in the preparation of nitrogen containing heterocyclic compounds.
General Description2-Bromo-6-methylpyridine is a bromopyridine derivative. It is formed when 2-chloro-6-methylpyridine is heated with bromotrimethylsilane. Its synthesis from various methods have been reported.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
149 records
Compound notes
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