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2,4-Dinitrofluoranthene

HCID 149088
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Basic information

CAS
102493-19-6
Standard SMILES
O=[N+]([O-])c1cc2c3c(ccc([N+](=O)[O-])c3c1)-c1ccccc1-2
InChIKey
DKHOIWAXCADMSA-UHFFFAOYSA-N
Molecular formula
C16H8N2O4
Average molar mass
292.24 g/mol
Monoisotopic mass
292.04840674

Names & identifiers

Preferred name
2,4-Dinitrofluoranthene
IUPAC
2,4-dinitrofluoranthene
English name
2,4-Dinitrofluoranthene
Molecular weight
0

Names & synonyms

2,4-DinitrofluorantheneFluoranthene, 2,4-dinitro-102493-19-6Fluoranthene, 2,4-dinitroBRN 5976030CHEMBL166654DTXSID10145193DKHOIWAXCADMSA-UHFFFAOYSA-N

Database identifiers

CAS
102493-19-6
PubChem CID
149088
DTXSID
DTXSID10145193
ChEMBL
CHEMBL166654
Nikkaji
J541.830E

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
91.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
22
Formal charge
0
Complexity
486

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