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887567-78-4 | 3-Bromo-4,6-difluoro-1H-indazole
CAS No: 887567-78-4 Catalog No: AG004CNV MDL No:MFCD07781822
Product Description
Catalog Number:
AG004CNV
Chemical Name:
3-Bromo-4,6-difluoro-1H-indazole
CAS Number:
887567-78-4
Molecular Formula:
C7H3BrF2N2
Molecular Weight:
233.0129
MDL Number:
MFCD07781822
IUPAC Name:
3-bromo-4,6-difluoro-2H-indazole
InChI:
InChI=1S/C7H3BrF2N2/c8-7-6-4(10)1-3(9)2-5(6)11-12-7/h1-2H,(H,11,12)
InChI Key:
OMGZJDWENSGDAU-UHFFFAOYSA-N
SMILES:
Fc1cc(F)c2c(c1)[nH]nc2Br
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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