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Home Carboxes 1000342-47-1
1000342-47-1,MFCD08690112
Catalog No.:AA0000GU
1000342-47-1 | 6-Chloro-3-iodo-5-nitro-1h-indazole
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
3 weeks  
$2,045.00   $1,432.00
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Technical Information
Catalog Number:
AA0000GU
Chemical Name:
6-Chloro-3-iodo-5-nitro-1h-indazole
CAS Number:
1000342-47-1
Molecular Formula:
C7H3ClIN3O2
Molecular Weight:
323.4751
MDL Number:
MFCD08690112
IUPAC Name:
6-chloro-3-iodo-5-nitro-2H-indazole
InChI:
InChI=1S/C7H3ClIN3O2/c8-4-2-5-3(7(9)11-10-5)1-6(4)12(13)14/h1-2H,(H,10,11)
InChI Key:
DBFHOJJVQRLTIO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2c(I)n[nH]c2cc1Cl
Properties
Computed Properties
 
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.896g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
323.474g/mol
Monoisotopic Mass:
322.896g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Synonyms
 
6-Chloro-3-iodo-5-nitro-1H-indazole 
1000342-47-1 
AX8281283 
W-1131 
DTXSID80646622 
ZINC14985645 
AKOS022173048 
6-chloro-3-iodo-5-nitro-2H-indazole 
FCH1389516 
6-Chloro-3-iodo-5-nitro (1H)indazole 
1H-Indazole, 6-chloro-3-iodo-5-nitro- 
AJ-66377 
Literature
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