2-Chloro-1,3,5-trinitro-4-[2-(2,4,6-trinitrophenyl)ethenyl]benzene

HCID 329469
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Basic information

CAS
59038-66-3
Standard SMILES
O=[N+]([O-])c1cc([N+](=O)[O-])c(C=Cc2c([N+](=O)[O-])cc([N+](=O)[O-])c(Cl)c2[N+](=O)[O-])c([N+](=O)[O-])c1
InChIKey
ZPFYDNJAMVFWMH-UHFFFAOYSA-N
Molecular formula
C14H5ClN6O12
Average molar mass
484.67 g/mol
Monoisotopic mass
483.96539728

Names & identifiers

Preferred name
2-Chloro-1,3,5-trinitro-4-[2-(2,4,6-trinitrophenyl)ethenyl]benzene
IUPAC
2-chloro-1,3,5-trinitro-4-[2-(2,4,6-trinitrophenyl)ethenyl]benzene

Names & synonyms

59038-66-3NSC3124602-chloro-1,3,5-trinitro-4-[2-(2,4,6-trinitrophenyl)ethenyl]benzeneSCHEMBL9637540DTXSID70317192ZPFYDNJAMVFWMH-UHFFFAOYSA-NNSC-3124603-chloro-2,2',4,4',6,6'-hexanitrostilbene2-Chloro-1,3,5-trinitro-4-[2-(2,4,6-trinitrophenyl)ethen-1-yl]benzene

Database identifiers

CAS
59038-66-3
PubChem CID
329469
DTXSID
DTXSID70317192

Properties

Computed structural propertiesFilling in

XLogP
3.8
Topological polar surface area
275 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
12
Rotatable bonds
2
Heavy atoms
33

Related reactions

1 records
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Compound notes

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