Basic information
- CAS
1784463-88-2- Standard SMILES
Cc1occ(C(F)(F)F)c1C=O- InChIKey
FXYAYNHZNIXOLX-UHFFFAOYSA-N- Molecular formula
- C7H5F3O2
- Average molar mass
- 178.11 g/mol
- Monoisotopic mass
- 178.02416388
Names & identifiers
- Preferred name
- 2-Methyl-4-(trifluoromethyl)furan-3-carbaldehyde
- IUPAC
- 2-methyl-4-(trifluoromethyl)furan-3-carbaldehyde
- English name
- 3-Furancarboxaldehyde, 2-methyl-4-(trifluoromethyl)-
- Molecular formula
- C7H5F3O2
- Molecular weight
- 178.11
Names & synonyms
2-methyl-4-(trifluoromethyl)furan-3-carbaldehyde1784463-88-2RefChem:475563958-701-0JWC46388AT17553EN300-1609224Z30374874273-Furancarboxaldehyde, 2-methyl-4-(trifluoromethyl)-
Database identifiers
- CAS
1784463-88-2- PubChem CID
- 84656271
- EC Number
- 958-701-0
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- Boiling point
- 175.5 · 175.5±40.0 °C(Predicted)
- Density
- 1.332 · 1.332±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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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 CategoriesFlam. Liq. 3 (100%)
Chemistry & industry
Suppliers1 total
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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