Basic information
- CAS
16574-52-0- Standard SMILES
O=C(c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1- InChIKey
GYZZOEFAMMXSIK-UHFFFAOYSA-N- Molecular formula
- C14H8F4O
- Average molar mass
- 268.21 g/mol
- Monoisotopic mass
- 268.05112752
Names & identifiers
- Preferred name
- 4-Fluoro-4'-(trifluoromethyl)benzophenone
- IUPAC
- (4-fluorophenyl)-[4-(trifluoromethyl)phenyl]methanone
- English name
- 4-fluoro-4'-(trifluoromethyl)benzophenone
- Molecular formula
- C14H8F4O
- Molecular weight
- 268.21
Names & synonyms
16574-52-0(4-Fluorophenyl)[4-(trifluoromethyl)phenyl]methanone4-Fluoro-4'-(trifluoromethyl)benzophenoneEINECS 240-633-1DTXSID90168022(4-fluorophenyl)(4-(trifluoromethyl)phenyl)methanoneRefChem:523250DTXCID3090513240-633-1Methanone, (4-fluorophenyl)[4-(trifluoromethyl)phenyl]-(4-fluorophenyl)-[4-(trifluoromethyl)phenyl]methanone4-Fluoro-4/'-(trifluoromethyl)benzophenone
Show more names
4-(Trifluoromethyl)-4'-fluorobenzophenone
4-Trifluoromethylphenyl-4-fluorophenyl ketoneVX35XTW5QHSCHEMBL7937285AKOS0052168694-Fluoro-4'-trifluoromethylbenzophenoneNS00053624EN300-129830G52236
Database identifiers
- CAS
16574-52-0- PubChem CID
- 85496
- DTXSID
DTXSID90168022- UNII
- VX35XTW5QH
- EC Number
- 240-633-1
- Nikkaji
- J318.254A
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 310
Physicochemical properties
- Melting point
- 100 · 100-101 °C(Solv: ethanol (64-17-5))
- Boiling point
- 164 · 164-165.5 °C(Press: 10 Torr)
- Density
- 1.306 · 1.306±0.06 g/cm3(Predicted)
- FDA UNII
- 35 XTW5QH · VX35XTW5QH
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
- H315-H335-H319-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers5 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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