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Home > Bromides > 1823338-32-4
1823338-32-4 | 2H-Indazole, 7-bromo-3-(methylsulfonyl)-
CAS No: 1823338-32-4 Catalog No: AG0023ND MDL No:
Product Description
Catalog Number:
AG0023ND
Chemical Name:
2H-Indazole, 7-bromo-3-(methylsulfonyl)-
CAS Number:
1823338-32-4
Molecular Formula:
C8H7BrN2O2S
Molecular Weight:
275.1224
IUPAC Name:
7-bromo-3-methylsulfonyl-2H-indazole
InChI:
InChI=1S/C8H7BrN2O2S/c1-14(12,13)8-5-3-2-4-6(9)7(5)10-11-8/h2-4H,1H3,(H,10,11)
InChI Key:
ANRLLYWAXOMLDO-UHFFFAOYSA-N
SMILES:
Brc1cccc2c1n[nH]c2S(=O)(=O)C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.941g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.12g/mol
Monoisotopic Mass:
273.941g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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