Basic information
- CAS
315233-67-1- Standard SMILES
COc1ccc2c(=O)c(-c3ccccc3C)c(C(F)(F)F)oc2c1C- InChIKey
ZJUTVVRTMDERNE-UHFFFAOYSA-N- Molecular formula
- C19H15F3O3
- Average molar mass
- 348.3 g/mol
- Monoisotopic mass
- 348.09732882
Names & identifiers
- Preferred name
- 7-methoxy-8-methyl-3-(2-methylphenyl)-2-(trifluoromethyl)-4H-chromen-4-one
- IUPAC
- 7-methoxy-8-methyl-3-(2-methylphenyl)-2-(trifluoromethyl)chromen-4-one
- English name
- 7-methoxy-8-methyl-3-(2-methylphenyl)-2-(trifluoromethyl)-4H-chromen-4-one
- Molecular formula
- C19H15F3O3
- Molecular weight
- 348.3158096
Names & synonyms
7-methoxy-8-methyl-3-(2-methylphenyl)-2-(trifluoromethyl)-4H-chromen-4-one7-methoxy-8-methyl-3-(2-methylphenyl)-2-(trifluoromethyl)chromen-4-oneAKOS001631747UNM000000565601AF-399/14944284SR-01000443984SR-01000443984-17-methoxy-8-methyl-3-(2-methylphenyl)-2-(trifluoromethyl)-4H-1-benzopyran-4-one315233-67-1
Database identifiers
- CAS
315233-67-1- PubChem CID
- 746423
- EC Number
- 126-575-9
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 555
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, 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%)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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