C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Cl
CAS: 97-00-7
Name: 1-chloro-2,4-dinitrobenzene
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Cl

Molecular Processing

Molecular formula
C6H3ClN2O4
Molecular weight
202.55
Exact mass
201.9781
XLogP
2.16
TPSA
86.28
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
44.76

Supplementary Information

InChIKey: VYZAHLCBVHPDDF-UHFFFAOYSA-N
Synonyme
1-chloro-2,4-dinitrobenzene2,4-Dinitrochlorobenzene97-00-7DinitrochlorobenzeneDNCBCDNB4-Chloro-1,3-dinitrobenzene2,4-Dinitrophenyl chlorideBenzene, 1-chloro-2,4-dinitro-Dinitrochlorobenzol1,3-Dinitro-4-chlorobenzene2,4-Dinitro-1-chlorobenzene6-Chloro-1,3-dinitrobenzene1-Chloro-2,4-dinitrobenzol1-Cloro-2,4-dinitrobenzeneNSC-6292DTXSID6020278GE3IBT7BMNCHEBI:347181-Chloro-2,4-dinitrobenzeenNSC6292DTXCID002782,4 dinitrochlorobenzene1 Chloro 2,4 Dinitrobenzene2-4 dinitrochlorobenzeneRefChem:134445202-551-4Chlorodinitrobenzene1-chloro-2,4-dinitro-benzene1-Chlor-2,4-dinitrobenzol
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