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Home > Bromides > 1017781-94-0
1017781-94-0 | 1H-Indazole, 3-bromo-5,6-difluoro-
CAS No: 1017781-94-0 Catalog No: AG0005II MDL No:MFCD09997805
Product Description
Catalog Number:
AG0005II
Chemical Name:
1H-Indazole, 3-bromo-5,6-difluoro-
CAS Number:
1017781-94-0
Molecular Formula:
C7H3BrF2N2
Molecular Weight:
233.0129
MDL Number:
MFCD09997805
IUPAC Name:
3-bromo-5,6-difluoro-2H-indazole
InChI:
InChI=1S/C7H3BrF2N2/c8-7-3-1-4(9)5(10)2-6(3)11-12-7/h1-2H,(H,11,12)
InChI Key:
BAWKUYQIZMQJJE-UHFFFAOYSA-N
SMILES:
Fc1cc2[nH]nc(c2cc1F)Br
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.945g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.016g/mol
Monoisotopic Mass:
231.945g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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