Ethyl 6-bromo-5-[(4-fluorophenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylate
Basic information
- CAS
308295-98-9- Standard SMILES
CCOC(=O)c1c(C)oc2cc(Br)c(OCc3ccc(F)cc3)cc12- InChIKey
TUROMKQCEKESPT-UHFFFAOYSA-N- Molecular formula
- C19H16BrFO4
- Average molar mass
- 407.2 g/mol
- Monoisotopic mass
- 406.0216
Names & identifiers
- Preferred name
- Ethyl 6-bromo-5-[(4-fluorophenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylate
- IUPAC
- ethyl 6-bromo-5-[(4-fluorophenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylate
- English name
- ethyl 6-bromo-5-((4-fluorobenzyl)oxy)-2-methylbenzofuran-3-carboxylate
- Molecular formula
- C19H16BrFO4
- Molecular weight
- 407.23
Names & synonyms
ethyl 6-bromo-5-[(4-fluorophenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylate308295-98-9ethyl 6-bromo-5-[(4-fluorobenzyl)oxy]-2-methyl-1-benzofuran-3-carboxylateETHYL 6-BROMO-5-((4-FLUOROBENZYL)OXY)-2-METHYL-1-BENZOFURAN-3-CARBOXYLATEOprea1_514742STK888043AKOS001633121ST50038588SR-01000445677SR-01000445677-1F0821-0389ethyl 6-bromo-5-((4-fluorobenzyl)oxy)-2-methylbenzofuran-3-carboxylate
Show more names
3-Benzofurancarboxylic acid, 6-bromo-5-[(4-fluorophenyl)methoxy]-2-methyl-, ethyl ester
ethyl 6-bromo-5-[(4-fluorophenyl)methoxy]-2-methylbenzo[b]furan-3-carboxylate
Database identifiers
- CAS
308295-98-9- PubChem CID
- 979604
- EC Number
- 122-500-9
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 48.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 455
Physicochemical properties
- Boiling point
- 479 · 479.0±40.0 °C(Predicted)
- Density
- 1.443 · 1.443±0.06 g/cm3(Predicted)
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, P337+P317, 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 CategoriesEye Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…