Home Bromides 429624-16-8
429624-16-8,MFCD02921806
Catalog No.:AA003I0L
429624-16-8 | 3-(4-Bromophenyl)-5-(3-nitrophenyl)-1,2,4-oxadiazole
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Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$86.00   $60.00
- +
5g
98%
in stock  
$258.00   $180.00
- +
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Technical Information
Catalog Number:
AA003I0L
Chemical Name:
3-(4-Bromophenyl)-5-(3-nitrophenyl)-1,2,4-oxadiazole
CAS Number:
429624-16-8
Molecular Formula:
C14H8BrN3O3
Molecular Weight:
346.1356
MDL Number:
MFCD02921806
IUPAC Name:
3-(4-bromophenyl)-5-(3-nitrophenyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C14H8BrN3O3/c15-11-6-4-9(5-7-11)13-16-14(21-17-13)10-2-1-3-12(8-10)18(19)20/h1-8H
InChI Key:
DBJSUPPXHAHSSP-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1noc(n1)c1cccc(c1)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
371  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.975g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.14g/mol
Monoisotopic Mass:
344.975g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

Synonyms
 
3-(4-bromophenyl)-5-(3-nitrophenyl)-1,2,4-oxadiazole 
429624-16-8 
STK143916 
AKOS001664138 
MCULE-8208753516 
RTR-016728 
AJ-10500 
CJ-00637 
TR-016728 
EU-0045699 
ST24022559 
V5928 
AC1LDT0N 
B-3572 
AB00110386-01 
SR-01000498896 
SR-01000498896-1 
I14-24866 
C14H8BrN3O3 
CID700582 
ZINC00080652 
3- -5- -1,2,4-OXADIAZOLE 
ACMC-209js4 
Cambridge id 6573016 
CTK4I6830 
ZINC80652 
DTXSID30351451 
ANW-29906 
MFCD02921806 
Literature
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