2,4-Dibromo-6-fluoroaniline
Basic information
- CAS
141474-37-5- Standard SMILES
Nc1c(F)cc(Br)cc1Br- InChIKey
YJLXEKFYZIBUPJ-UHFFFAOYSA-N- Molecular formula
- C6H4Br2FN
- Average molar mass
- 268.91 g/mol
- Monoisotopic mass
- 266.86945155
Names & identifiers
- Preferred name
- 2,4-Dibromo-6-fluoroaniline
- IUPAC
- 2,4-dibromo-6-fluoroaniline
- English name
- 2,4-Dibromo-6-fluoroaniline
- Molecular formula
- C6H4Br2FN
- Molecular weight
- 268.91
Names & synonyms
2,4-dibromo-6-fluoroaniline141474-37-5DTXSID40371584RefChem:443223DTXCID00322618604-235-5MFCD00042230Benzenamine, 2,4-dibromo-6-fluoro-2,4-dibromo-6-fluoro-anilineBenzenamine,2,4-dibromo-6-fluoro-SCHEMBL1639935AKOS005257961
Show more names
2,4-Dibromo-6-fL2,4-DIBROMO-6-FLUORO2,4-Dibromo-6-fluoroaniline98%2,4-Dibromo-6-fluoroaniline 98%2,4-Dibromo-6-fluoro phenylamine, 98%Tianfu Chem 2,4-DIBROMO-6-FLUOROANILINE2,4-DIBROMO-6-FLUOROANILINE ISO 9001：2015 REACH
CS-W009446PS-102022,4-dibromo-6-fluoro anilineAM613134,6-dibromo-2-fluorophenylamineDB-042566NS00126936ST50319913
Database identifiers
- CAS
141474-37-5- PubChem CID
- 2736765
- DTXSID
DTXSID40371584- EC Number
- 604-235-5
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 122
Physicochemical properties
- Melting point
- 59 · 59-64 °C(lit.)
- Boiling point
- 245.7 · 245.7±35.0 °C(Predicted)
- Density
- 2.096 · 2.096±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 0.44 · 0.44±0.10(Predicted)
- Appearance
- Brown to reddish brown Solid
- BRN
- 6289292 · 6289292
- InChI
- InChI=1S/C6H4Br2FN/c7-3-1-4(8)6(10)5(9)2-3/h1-2H,10H2
- InChIKey
- YJLXEKFYZIBUPJ-UHFFFAOYSA-N
- SMILES
- C1(N)=C(F)C=C(Br)C=C1Br
- CAS DataBase Reference
- 141474 · 141474-37-5(CAS DataBase Reference)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H315-H319-H331-H335
- Precautionary statements
- 261 · P261-P280-P304+P340-P305+P351+P338-P405-P501a
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 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- ridadr
- UN2811
- hs_code
- 2921420090
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS06
- hazard_code
- Xn,T,Xi
- hazard_note
- Toxic
- safety_code
- 26-36-36/37/39
- hazard_class
- 6.1
- packing_group
- III
- Hazard statements
- H302-H312-H315-H319-H331-H335
- 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)
Chemistry & industry
Applications
Uses2,4-DIBROMO-6-FLUOROANILINE is used as pharmaceutical, pesticide, and liquid crystal material intermediates.
Related reactions
1 records
Compound notes
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