2,4-Difluoro-6-nitrophenol
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Basic information
- CAS
364-31-8- Standard SMILES
O=[N+]([O-])c1cc(F)cc(F)c1O- InChIKey
MZVKNFPDQWHQKT-UHFFFAOYSA-N- Molecular formula
- C6H3F2NO3
- Average molar mass
- 175.09 g/mol
- Monoisotopic mass
- 175.00809928
Names & identifiers
- Preferred name
- 2,4-Difluoro-6-nitrophenol
- IUPAC
- 2,4-difluoro-6-nitrophenol
- English name
- 2,4-DIFLUORO-6-NITROPHENOL
- Molecular formula
- C6H3F2NO3
- Molecular weight
- 175.09
Names & synonyms
2,4-Difluoro-6-nitrophenol364-31-82,4-Difluoro-6-nitro-phenolPhenol, 2,4-difluoro-6-nitro-MFCD03094186NSC10261SCHEMBL20788162,4-Difluoro-6-nitrophenol #DTXSID10278834NSC-10261AKOS009159499DS-5121
Show more names
2,6-Difluoro-6-nitrophenol2,4-Difluoro-6-nitrophenol97%2,4-Difluoro-6-nitrophenol 97%5-Amino-1,4-dimethyl-1H-pyrazole-3-carboxylic acid
SY2803763,5-Difluoro-2-hydroxynitrobenzene6-chloronicotinylchlorid4,6-difluoro-2-nitrophenolSBB088996DB-019925CS-0134477EN300-199434
Database identifiers
- CAS
364-31-8- PubChem CID
- 223083
- DTXSID
DTXSID10278834
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Boiling point
- 211.1 · 211.1±35.0 °C(Predicted)
- Density
- 1.619 · 1.619±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 5.32 · 5.32±0.38(Predicted)
- Appearance
- Light yellow to yellow Solid
- CAS DataBase Reference
- 364 · 364-31-8(CAS DataBase Reference)
- Symbol(GHS)
- 5 · GHS05,GHS07,GHS09
- Signal word
- Danger
- Hazard statements
- 302 · H302-H315-H317-H318-H410
- Precautionary statements
- 261 · P261-P264-P270-P272-P273-P280-P301+P312+P330-P302+P352-P305+P351+P338+P310-P333+P313-P391-P501
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2908990000 · 2908990000
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
- hs_code
- 2908990000
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07,GHS09
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302-H315-H317-H318-H410
- Precautionary statements
- P261-P264-P270-P272-P273-P280-P301+P312+P330-P302+P352-P305+P351+P338+P310-P333+P313-P391-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
2 records
Compound notes
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