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885519-92-6 | 3-Bromo-6-chloro-4-nitro-1H-indazole
CAS No: 885519-92-6 Catalog No: AG004F4I MDL No:MFCD07781689
Product Description
Catalog Number:
AG004F4I
Chemical Name:
3-Bromo-6-chloro-4-nitro-1H-indazole
CAS Number:
885519-92-6
Molecular Formula:
C7H3BrClN3O2
Molecular Weight:
276.4746
MDL Number:
MFCD07781689
IUPAC Name:
3-bromo-6-chloro-4-nitro-2H-indazole
InChI:
InChI=1S/C7H3BrClN3O2/c8-7-6-4(10-11-7)1-3(9)2-5(6)12(13)14/h1-2H,(H,10,11)
InChI Key:
HMTZZHGVKDVBPI-UHFFFAOYSA-N
SMILES:
Clc1cc2[nH]nc(c2c(c1)[N+](=O)[O-])Br
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.91g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
276.474g/mol
Monoisotopic Mass:
274.91g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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