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Ether, bis(alpha-chloro-2-nitrobenzyl)

HCID 49745
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Basic information

CAS
67272-21-3
Standard SMILES
O=[N+]([O-])c1ccccc1C(Cl)OC(Cl)c1ccccc1[N+](=O)[O-]
InChIKey
WGPAGWJJNNQKQP-UHFFFAOYSA-N
Molecular formula
C14H10Cl2N2O5
Average molar mass
357.1 g/mol
Monoisotopic mass
355.9966768

Names & identifiers

Preferred name
Ether, bis(alpha-chloro-2-nitrobenzyl)
IUPAC
1-[chloro-[chloro-(2-nitrophenyl)methoxy]methyl]-2-nitrobenzene
English name
Bis(α-chloro-2-nitrobenzyl) ether
Molecular formula
C14H10Cl2N2O5
Molecular weight
357.15

Names & synonyms

BRN 3476920ETHER, BIS(alpha-CHLORO-2-NITROBENZYL)Ether alpha,alpha'-dichloro-2,2'-dibenzylique [French]67272-21-3Ether alpha,alpha'-dichloro-2,2'-dibenzylique0-07-00-00248 (Beilstein Handbook Reference)RefChem:341558DTXSID509864661,1'-[Oxybis(chloromethylene)]bis(2-nitrobenzene)Bis(α-chloro-2-nitrobenzyl) etherBenzene, 1,1'-[oxybis(chloromethylene)]bis[2-nitro- (9CI)

Database identifiers

CAS
67272-21-3
PubChem CID
49745
DTXSID
DTXSID50986466
Nikkaji
J92.985I

Properties

Computed structural propertiesFilling in

XLogP
4.2
Topological polar surface area
101 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
23
Formal charge
0
Complexity
390

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