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Home Bromides 1000343-58-7
1000343-58-7,MFCD09026989
Catalog No.:AA0000IR
1000343-58-7 | 3-Bromo-6-methyl-5-nitro-1H-indazole
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95+%
1 week  
$83.00   $58.00
- +
250mg
95+%
1 week  
$115.00   $81.00
- +
1g
95+%
1 week  
$283.00   $198.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA0000IR
Chemical Name:
3-Bromo-6-methyl-5-nitro-1H-indazole
CAS Number:
1000343-58-7
Molecular Formula:
C8H6BrN3O2
Molecular Weight:
256.0561
MDL Number:
MFCD09026989
IUPAC Name:
3-bromo-6-methyl-5-nitro-2H-indazole
InChI:
InChI=1S/C8H6BrN3O2/c1-4-2-6-5(8(9)11-10-6)3-7(4)12(13)14/h2-3H,1H3,(H,10,11)
InChI Key:
GIOGUISZUYCHAK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2c(Br)n[nH]c2cc1C
Properties
Computed Properties
 
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.964g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.059g/mol
Monoisotopic Mass:
254.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Synonyms
 
3-Bromo-6-methyl-5-nitro-1H-indazole 
1000343-58-7 
MFCD09026989 
SBB101665 
ZINC14985781 
AKOS005071732 
AD-5010 
FCH1390241 
MCULE-3505978322 
OR18056 
RP14516 
3-bromo-6-methyl-5-nitro-2H-indazole 
SCHEMBL1199907 
KS-0000220U 
AJ-66430 
AK-67321 
AX8207871 
TR-070921 
C8H6BrN3O2 
C10H11BrN2 
4-Bromo-6-isopropyl-1H-indazole 
1000343-77-0 
CTK5I2871 
DTXSID00646664 
GIOGUISZUYCHAK-UHFFFAOYSA-N 
ZX-AT013089 
3-Bromo-6-methyl-5-nitro indazole 
0053AA 
7065AC 
Literature
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