Basic information
- CAS
303095-16-1- Standard SMILES
COc1ccc(C(=O)COc2ccc(F)cc2)c(O)c1C- InChIKey
YZKPBGXNXRFBNI-UHFFFAOYSA-N- Molecular formula
- C16H15FO4
- Average molar mass
- 290.29 g/mol
- Monoisotopic mass
- 290.09543712
Names & identifiers
- Preferred name
- 2-(4-Fluorophenoxy)-1-(2-hydroxy-4-methoxy-3-methylphenyl)ethanone
- IUPAC
- 2-(4-fluorophenoxy)-1-(2-hydroxy-4-methoxy-3-methylphenyl)ethanone
- English name
- 2-(4-fluorophenoxy)-1-(2-hydroxy-4-methoxy-3-methylphenyl)ethan-1-one
- Molecular formula
- C16H15FO4
- Molecular weight
- 290.29
Names & synonyms
2-(4-fluorophenoxy)-1-(2-hydroxy-4-methoxy-3-methylphenyl)ethanone303095-16-1RefChem:457658683-996-5Oprea1_446349MLS000689962CHEMBL1719746HMS2635D05HMS3364D11AKOS003614516CCG-327817SMR000298680
Show more names
Ethanone, 2-(4-fluorophenoxy)-1-(2-hydroxy-4-methoxy-3-methylphenyl)-2-(4-fluorophenoxy)-1-(2-hydroxy-4-methoxy-3-methylphenyl)ethan-1-one
AB00115091-01SR-01000240727SR-01000240727-1
Database identifiers
- CAS
303095-16-1- PubChem CID
- 797374
- ChEMBL
CHEMBL1719746- EC Number
- 683-996-5
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 341
Physicochemical properties
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 400 · H400
- Precautionary statements
- 273 · P273-P391-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
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H400
- Precautionary statements
- P273-P391-P501
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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