Molecular Identity
2,4,7-Trinitrofluoren-9-one
2,4,7-trinitrofluoren-9-one
PubChem CID: 8521
2D Structure
Properties
C13H5N3O7
Molecular Formula
315.19
Molecular Weight
g/mol
315.0127
Exact Mass
Da
2.4
XLogP
Drug-like (Lipinski: < 5)
155
TPSA
May have limited oral absorption
0
H-Bond Donors
7
H-Bond Acceptors
563
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=C2C(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]Isomeric SMILES
SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=C2C(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]Synonyms(20)
2,4,7-Trinitrofluoren-9-one129-79-32,4,7-TRINITRO-9H-FLUOREN-9-ONE2,4,7-TrinitrofluorenoneTNF (ketone)2,4,7-Trinitro-9-fluorenone2,4,7-TrinitrofluoroneFluoren-9-one, 2,4,7-trinitro-B2290YT0WBNSC-12367DTXSID1026245RefChem:82196DTXCID206245204-965-09H-Fluoren-9-one, 2,4,7-trinitro-
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 2,4,7-Trinitrofluoren-9-one
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