4-(2,4-Difluorophenoxy)-3-nitrobenzenecarbaldehyde
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Basic information
- CAS
173282-22-9- Standard SMILES
O=Cc1ccc(Oc2ccc(F)cc2F)c([N+](=O)[O-])c1- InChIKey
RINTXUSUROIDBP-UHFFFAOYSA-N- Molecular formula
- C13H7F2NO4
- Average molar mass
- 279.19 g/mol
- Monoisotopic mass
- 279.03431403
Names & identifiers
- Preferred name
- 4-(2,4-Difluorophenoxy)-3-nitrobenzenecarbaldehyde
- IUPAC
- 4-(2,4-difluorophenoxy)-3-nitrobenzaldehyde
- English name
- 4-(2,4-DIFLUOROPHENOXY)-3-NITROBENZENECARBALDEHYDE
- Molecular formula
- C13H7F2NO4
- Molecular weight
- 279.2
Names & synonyms
173282-22-94-(2,4-difluorophenoxy)-3-nitrobenzaldehyde4-(2,4-difluorophenoxy)-3-nitrobenzenecarbaldehydeMFCD00794806Oprea1_076113SCHEMBL13220974DTXSID40363166AKOS0050705465L-501SCS-03184404-(2,4-difluorophenoxy)-3-nitro-benzaldehydeW15167
Show more names
4-(2,4-difluorophenoxy)-3-nitrobenzaldehyde*Benzaldehyde, 4-(2,4-difluorophenoxy)-3-nitro-4-(2,4-difluorophenoxy)-3-nitrobenzaldehyde(WX180084)
4-(2,4-difluorophenoxy)-3-nitrobenzene carbaldehyde
Database identifiers
- CAS
173282-22-9- PubChem CID
- 1479482
- DTXSID
DTXSID40363166
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 363
Physicochemical properties
- Melting point
- 88 · 88-90°
- Boiling point
- 341.5 · 341.5±42.0 °C(Predicted)
- Density
- 1.454 · 1.454±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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