6-Bromo-2-fluoro-3-(trifluoromethyl)benzaldehyde
Basic information
- CAS
1055176-30-1- Standard SMILES
O=Cc1c(Br)ccc(C(F)(F)F)c1F- InChIKey
WEMMKWCCQNHYIO-UHFFFAOYSA-N- Molecular formula
- C8H3BrF4O
- Average molar mass
- 271.01 g/mol
- Monoisotopic mass
- 269.93034
Names & identifiers
- Preferred name
- 6-Bromo-2-fluoro-3-(trifluoromethyl)benzaldehyde
- IUPAC
- 6-bromo-2-fluoro-3-(trifluoromethyl)benzaldehyde
- English name
- 6-BroMo-2-fluoro-3-(trifluoroMethyl)benzaldehyde
- Molecular formula
- C8H3BrF4O
- Molecular weight
- 271.01
Names & synonyms
6-bromo-2-fluoro-3-(trifluoromethyl)benzaldehyde1055176-30-1RefChem:540732966-704-3MFCD166586566-bromo-2-fluoro-3-trifluoromethyl-benzaldehydeSCHEMBL1015538SCHEMBL20641718FSB17630XH1033AKOS025404062AS-43183
Show more names
6-bromo-2-fluoro-3-(trifluoromethyl)benzenemethylaldehyde
SY067998F473531Benzaldehyde, 6-bromo-2-fluoro-3-(trifluoromethyl)-6-Bromo-2-fluoro-3-(trifluoromethyl)benzaldehyde, AldrichCPR
Database identifiers
- CAS
1055176-30-1- PubChem CID
- 10236304
- EC Number
- 966-704-3
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 218
Physicochemical properties
- Boiling point
- 243.5 · 243.5±35.0 °C(Predicted)
- Density
- 1.748 · 1.748±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 261 · P261-P280-P305+P351+P338-P304+P340-P405-P501
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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P261-P280-P305+P351+P338-P304+P340-P405-P501
Chemistry & industry
Upstream & downstream products
Downstream products
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Related reactions
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Compound notes
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