2-Bromo-1,3,4,5-tetrafluorobenzene
Basic information
- CAS
1559-86-0- Standard SMILES
Fc1cc(F)c(Br)c(F)c1F- InChIKey
AHJRONLVHNFUNH-UHFFFAOYSA-N- Molecular formula
- C6HBrF4
- Average molar mass
- 228.97 g/mol
- Monoisotopic mass
- 227.91978
Names & identifiers
- Preferred name
- 2-Bromo-1,3,4,5-tetrafluorobenzene
- IUPAC
- 2-bromo-1,3,4,5-tetrafluorobenzene
- English name
- 1-bromo-2,3,4,6-tetrafluorobenzene
- Molecular formula
- C6HBrF4
- Molecular weight
- 228.97
Names & synonyms
1559-86-02-Bromo-1,3,4,5-tetrafluorobenzeneEINECS 216-325-8DTXSID00165986RefChem:465783DTXCID9088477216-325-81-Bromo-2,3,4,6-tetrafluorobenzeneBenzene, 2-bromo-1,3,4,5-tetrafluoro-1,2,3,5-tetrafluoro-4-bromobenzene2-bromo-1,3,4,5-tetrafluoro-benzeneRB2PYS9NWB
Show more names
4-flurobenzoic acid1-bromo-2,3,4,6-tetr1-Bromo-2,3,4,6-tetrafL2,3,4,6-TetrafluorobromobenzeneN-[(3-chlorophenyl)methyl]-2-(1H-indol-3-yl)ethanamine
SCHEMBL2933659SCHEMBL31258564QAA85770MFCD00000303AKOS0243193172-Bromo-1,3,4,5-tetrafluorobenzene #NS00048436H70465
Database identifiers
- CAS
1559-86-0- PubChem CID
- 73792
- DTXSID
DTXSID00165986- UNII
- RB2PYS9NWB
- EC Number
- 216-325-8
- Nikkaji
- J206.788I
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 143
Physicochemical properties
- Boiling point
- 141 · 141-142 °C
- Density
- 1.862 g/mL · 1.862 g/mL at 25 °C(lit.)
- FDA UNII
- 2 PYS9NWB · RB2PYS9NWB
- Symbol(GHS)
- 7 · GHS07,GHS02
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335-H226
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- Xi
- Risk Statements
- 10 · 10-36/37/38
- Safety Statements
- 16 · 16-26-36
- RIDADR
- 1993 · 1993
- HazardClass
- 3.2 · 3.2
- PackingGroup
- III
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
H226 (100%): 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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- ridadr
- 1993
- risk_code
- 10-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS02
- hazard_code
- Xi
- safety_code
- 16-26-36
- hazard_class
- 3.2
- packing_group
- III
- Hazard statements
- H319-H315-H335-H226
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
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Related reactions
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Compound notes
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