2,4-Difluoro-5-nitroanisole
Basic information
- CAS
179011-39-3- Standard SMILES
COc1cc([N+](=O)[O-])c(F)cc1F- InChIKey
UWQOVGHBTZMFAF-UHFFFAOYSA-N- Molecular formula
- C7H5F2NO3
- Average molar mass
- 189.12 g/mol
- Monoisotopic mass
- 189.02374946
Names & identifiers
- Preferred name
- 2,4-Difluoro-5-nitroanisole
- IUPAC
- 1,5-difluoro-2-methoxy-4-nitrobenzene
- English name
- 2,4-Difluoro-5-methoxynitrobenzene
- Molecular formula
- C7H5F2NO3
- Molecular weight
- 189.12
Names & synonyms
2,4-Difluoro-5-nitroanisoleRefChem:443542690-819-51,5-difluoro-2-methoxy-4-nitrobenzene179011-39-32,4-Difluoro-5-methoxynitrobenzeneBenzene, 1,5-difluoro-2-methoxy-4-nitro-MFCD086896751,5-difluoro-2-methoxy-4-nitro-benzeneNSC10322SCHEMBL512256SCHEMBL29804996
Show more names
2,4-Difluoro-5-nitrophenyl methyl ether1,5-Difluoro-2-methoxy-4-nitrobenzene - [D94603]2,4-Difluoro-5-methoxynitrobenzene, 1,5-Difluoro-2-methoxy-4-nitrobenzene, 2,4-Difluoro-5-nitrophenyl methyl ether
DTXSID40278847UWQOVGHBTZMFAF-UHFFFAOYSA-NNSC 10322NSC-10322SBB090893XH1163AKOS005072399EA-0606
Database identifiers
- CAS
179011-39-3- PubChem CID
- 223099
- DTXSID
DTXSID40278847- EC Number
- 690-819-5
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 197
Physicochemical properties
- Boiling point
- 283.4 · 283.4±35.0 °C(Predicted)
- Density
- 1.414 · 1.414±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- form
- crystalline powder
- color
- Golden yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338-P304+P340-P405-P501
- HS Code
- 2909309090 · 2909309090
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2909309090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P305+P351+P338-P304+P340-P405-P501
Related reactions
4 records
Compound notes
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