1,3,5-Trifluoro-2,4-dinitrobenzene

HCID 223076
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Basic information

CAS
392-51-8
Standard SMILES
O=[N+]([O-])c1c(F)cc(F)c([N+](=O)[O-])c1F
InChIKey
CJMQRMFXSRLCQI-UHFFFAOYSA-N
Molecular formula
C6HF3N2O4
Average molar mass
222.08 g/mol
Monoisotopic mass
221.98884117

Names & identifiers

Preferred name
1,3,5-Trifluoro-2,4-dinitrobenzene
IUPAC
1,3,5-trifluoro-2,4-dinitrobenzene

Names & synonyms

1,3,5-trifluoro-2,4-dinitrobenzene392-51-8NSC102361,3,5-trifluoro-2,4-dinitro-benzeneC6HF3N2O4SCHEMBL4892856SCHEMBL9126903DTXSID60278829CJMQRMFXSRLCQI-UHFFFAOYSA-NMFCD00449273NSC-10236AKOS037652923
Show more names
FS-4232F075974

Database identifiers

CAS
392-51-8
PubChem CID
223076
DTXSID
DTXSID60278829
Nikkaji
J700.810D

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
91.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
0
Heavy atoms
15

Related reactions

1 records
New reaction record

Compound notes

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