2-Chloro-1,5-difluoro-3-nitrobenzene
Basic information
- CAS
36556-59-9- Standard SMILES
O=[N+]([O-])c1cc(F)cc(F)c1Cl- InChIKey
RUWWVEDLBSUWIX-UHFFFAOYSA-N- Molecular formula
- C6H2ClF2NO2
- Average molar mass
- 193.53 g/mol
- Monoisotopic mass
- 192.9742123
Names & identifiers
- Preferred name
- 2-Chloro-1,5-difluoro-3-nitrobenzene
- IUPAC
- 2-chloro-1,5-difluoro-3-nitrobenzene
- English name
- 2-chloro-1,5-difluoro-3-nitrobenzene
- Molecular formula
- C6H2ClF2NO2
- Molecular weight
- 193.54
Names & synonyms
36556-59-92-Chloro-1,5-difluoro-3-nitrobenzeneEINECS 253-101-9DTXSID20190058RefChem:86115DTXCID30112549253-101-92-Chloro-3,5-difluoronitrobenzeneMFCD009739752-Chloro-35-difluoronitrobenzene2-chloro-1,5-difluoro-3-nitro-benzeneDSX9492ZNC
Show more names
1-Chloro-2,4-difluor-6-onitrobenzene2-chloro-1,5-difluoro-3-nitrobenzene ISO 9001：2015 REACH
SCHEMBL8374757RUWWVEDLBSUWIX-UHFFFAOYSA-NAKOS006274283DS-2722Benzene, 2-chloro-1,5-difluoro-3-nitro-NS00057402F237394
Database identifiers
- CAS
36556-59-9- PubChem CID
- 119013
- DTXSID
DTXSID20190058- UNII
- DSX9492ZNC
- EC Number
- 253-101-9
- Nikkaji
- J332.313G
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 187
Physicochemical properties
- Boiling point
- 238.6 · 238.6±35.0 °C(Predicted)
- Density
- 1.591 · 1.591±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- FDA UNII
- 9492 ZNC · DSX9492ZNC
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2904990090 · 2904990090
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
- 2904990090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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