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459133-66-5

459133-66-5 | 5-Bromo-3-iodo-1H-indazole

CAS No: 459133-66-5 Catalog No: AG0038PF MDL No:MFCD07781637

Product Description

Catalog Number:
AG0038PF
Chemical Name:
5-Bromo-3-iodo-1H-indazole
CAS Number:
459133-66-5
Molecular Formula:
C7H4BrIN2
Molecular Weight:
322.9285
MDL Number:
MFCD07781637
IUPAC Name:
5-bromo-3-iodo-2H-indazole
InChI:
InChI=1S/C7H4BrIN2/c8-4-1-2-6-5(3-4)7(9)11-10-6/h1-3H,(H,10,11)
InChI Key:
IBFAYUXCRDDBRD-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(I)n[nH]2

Properties

Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.86g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
322.931g/mol
Monoisotopic Mass:
321.86g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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