1-Chloro-3-[4-(trifluoromethyl)phenyl]propan-2-one
Basic information
- CAS
880360-24-7- Standard SMILES
O=C(CCl)Cc1ccc(C(F)(F)F)cc1- InChIKey
KUKOOJKYHOJGLR-UHFFFAOYSA-N- Molecular formula
- C10H8ClF3O
- Average molar mass
- 236.62 g/mol
- Monoisotopic mass
- 236.0215771
Names & identifiers
- Preferred name
- 1-Chloro-3-[4-(trifluoromethyl)phenyl]propan-2-one
- IUPAC
- 1-chloro-3-[4-(trifluoromethyl)phenyl]propan-2-one
Names & synonyms
1-chloro-3-[4-(trifluoromethyl)phenyl]propan-2-one880360-24-71-Chloro-3-(4-(trifluoromethyl)phenyl)propan-2-oneRefChem:431290994-095-4MFCD16616549AKOS017549578SY526077EN300-2032797Z1386913663
Database identifiers
- CAS
880360-24-7- PubChem CID
- 79015960
- EC Number
- 994-095-4
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 219
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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