7-[(2,6-dichlorobenzyl)oxy]-4-(trifluoromethyl)-2H-chromen-2-one
Basic information
- CAS
372975-03-6- Standard SMILES
O=c1cc(C(F)(F)F)c2ccc(OCc3c(Cl)cccc3Cl)cc2o1- InChIKey
JBHFORVXKMMOJS-UHFFFAOYSA-N- Molecular formula
- C17H9Cl2F3O3
- Average molar mass
- 389.1 g/mol
- Monoisotopic mass
- 387.988084
Names & identifiers
- Preferred name
- 7-[(2,6-dichlorobenzyl)oxy]-4-(trifluoromethyl)-2H-chromen-2-one
- IUPAC
- 7-[(2,6-dichlorophenyl)methoxy]-4-(trifluoromethyl)chromen-2-one
- English name
- 7-[(2,6-dichlorophenyl)methoxy]-4-(trifluoromethyl)chromen-2-one
- Molecular formula
- C17H9Cl2F3O3
- Molecular weight
- 389.15
Names & synonyms
372975-03-67-[(2,6-dichlorobenzyl)oxy]-4-(trifluoromethyl)-2H-chromen-2-one7-((2,6-DICHLOROBENZYL)OXY)-4-(TRIFLUOROMETHYL)-2H-CHROMEN-2-ONESTL225209AKOS001055078Z258716787-[(2,6-dichlorophenyl)methoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one7-[(2,6-dichlorophenyl)methoxy]-4-(trifluoromethyl)chromen-2-one2H-1-Benzopyran-2-one, 7-[(2,6-dichlorophenyl)methoxy]-4-(trifluoromethyl)-
Database identifiers
- CAS
372975-03-6- PubChem CID
- 2277337
- EC Number
- 140-031-8
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 528
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P273, P301+P316, P321, P330, 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. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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