Basic information
- CAS
872365-91-8- Standard SMILES
FC(F)c1cccc(Br)n1- InChIKey
ZTBGDNNRDRISQZ-UHFFFAOYSA-N- Molecular formula
- C6H4BrF2N
- Average molar mass
- 208 g/mol
- Monoisotopic mass
- 206.94952
Names & identifiers
- Preferred name
- 2-Bromo-6-(difluoromethyl)pyridine
- IUPAC
- 2-bromo-6-(difluoromethyl)pyridine
- English name
- 2-Bromo-6-(difluoromethyl)pyridine
- Molecular formula
- C6H4BrF2N
- Molecular weight
- 208
Names & synonyms
Show more names
Database identifiers
- CAS
872365-91-8- PubChem CID
- 10104489
- DTXSID
DTXSID20435653- EC Number
- 689-417-2
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- Density
- 1.703 g/mL · 1.703 g/mL at 25 °C
- refractive index
- 1.52 · 1.520
- Flash point
- 110 ℃ · 110℃
- storage temp.
- 2 · 2-8°C
- form
- liquid
- Appearance
- Colorless to light yellow Liquid
- InChI
- InChI=1S/C6H4BrF2N/c7-5-3-1-2-4(10-5)6(8)9/h1-3,6H
- InChIKey
- ZTBGDNNRDRISQZ-UHFFFAOYSA-N
- SMILES
- C1(Br)=NC(C(F)F)=CC=C1
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H315-H319
- Precautionary statements
- 301 · P301+P310+P330-P302+P352-P305+P351+P338
- Hazard Codes
- T
- Risk Statements
- 25 · 25-36/37/38
- Safety Statements
- 26 · 26-45
- RIDADR
- 2810 · UN 2810 6.1 / PGIII
- WGK Germany
- 3 · 3
- HazardClass
- 6.1 · 6.1
- HS Code
- 2933399990 · 2933399990
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Safety & regulation
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264, P264+P265, P270, P280, P301+P316, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Safety data
- wgk
- 3
- ridadr
- UN 2810 6.1 / PGIII
- hs_code
- 2933399990
- risk_code
- 25-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- T
- safety_code
- 26-45
- hazard_class
- 6.1
- Hazard statements
- H301-H315-H319
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Precautionary statements
- P301+P310+P330-P302+P352-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers57 total
Related reactions
Compound notes
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