2,3-Difluoro-5-nitrophenol
Basic information
- CAS
1119455-04-7- Standard SMILES
O=[N+]([O-])c1cc(O)c(F)c(F)c1- InChIKey
QEBOTENBPZWUEC-UHFFFAOYSA-N- Molecular formula
- C6H3F2NO3
- Average molar mass
- 175.09 g/mol
- Monoisotopic mass
- 175.00809928
Names & identifiers
- Preferred name
- 2,3-Difluoro-5-nitrophenol
- IUPAC
- 2,3-difluoro-5-nitrophenol
- English name
- 2,3-Difluoro-5-nitrophenol
- Molecular formula
- C6H3F2NO3
- Molecular weight
- 175.09
Names & synonyms
2,3-Difluoro-5-nitrophenol1119455-04-72,3-Difluoro-5-nitro-phenolMFCD120263842,3--Difluoro-5-nitrophenolSCHEMBL964914SCHEMBL8105000DTXSID50623001QEBOTENBPZWUEC-UHFFFAOYSA-NAKOS006318712AB92764CS-W001296
Show more names
Phenol, 2,3-difluoro-5-nitro-2,3-Difluoro-5-nitrophenol 98%
DS-5515
Database identifiers
- CAS
1119455-04-7- PubChem CID
- 22154656
- DTXSID
DTXSID50623001
Properties
Computed structural properties
- XLogP
- 1.6
- 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
- 269 · 269.0±40.0 °C(Predicted)
- Density
- 1.619 · 1.619±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 5.96 · 5.96±0.24(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H302+H312+H332-H315
- Precautionary statements
- 280 · P280-P301+P312
- 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
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H302+H312+H332-H315
- Precautionary statements
- P280-P301+P312
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
7 records
Compound notes
Loading…