Home Nitro Compounds 74229-71-3
74229-71-3,MFCD01624374
Catalog No.:AA003IGY
74229-71-3 | 3,5-Bis(3-nitrophenyl)-1,2,4-oxadiazole
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1g
95%
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$86.00   $60.00
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5g
95%
in stock  
$258.00   $180.00
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Technical Information
Catalog Number:
AA003IGY
Chemical Name:
3,5-Bis(3-nitrophenyl)-1,2,4-oxadiazole
CAS Number:
74229-71-3
Molecular Formula:
C14H8N4O5
Molecular Weight:
312.2371
MDL Number:
MFCD01624374
IUPAC Name:
3,5-bis(3-nitrophenyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C14H8N4O5/c19-17(20)11-5-1-3-9(7-11)13-15-14(23-16-13)10-4-2-6-12(8-10)18(21)22/h1-8H
InChI Key:
DLOMOIFOKNNPRG-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)c1onc(n1)c1cccc(c1)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
451  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.049g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.241g/mol
Monoisotopic Mass:
312.049g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

Synonyms
 
3,5-bis(3-nitrophenyl)-1,2,4-oxadiazole 
74229-71-3 
AKOS001664139 
MCULE-2805243339 
AJ-25372 
CJ-04857 
TR-023993 
ST24022462 
V7572 
3,5-bis-(3-Nitrophenyl)-1,2,4-oxadiazole 
B-3907 
I14-24564 
ACMC-209otv 
C14H8N4O5 
3,5-Bis -1,2,4-oxadiazole 
ZINC01313773 
CID1422753 
AC1LRE46 
CTK5D9575 
DTXSID20362915 
ZINC1313773 
ANW-36449 
MFCD01624374 
STK321442 
Literature
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