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Home > Boronic Acids > 1253911-24-8
1253911-24-8 | 4-Fluoro-1h-indazol-6-ylboronic acid
CAS No: 1253911-24-8 Catalog No: AG00HI6X MDL No:MFCD18383477
Product Description
Catalog Number:
AG00HI6X
Chemical Name:
4-Fluoro-1h-indazol-6-ylboronic acid
CAS Number:
1253911-24-8
Molecular Formula:
C7H6BFN2O2
Molecular Weight:
179.9441
MDL Number:
MFCD18383477
IUPAC Name:
(4-fluoro-1H-indazol-6-yl)boronic acid
InChI:
InChI=1S/C7H6BFN2O2/c9-6-1-4(8(12)13)2-7-5(6)3-10-11-7/h1-3,12-13H,(H,10,11)
InChI Key:
BDQHXQXQAVKTSF-UHFFFAOYSA-N
SMILES:
OB(c1cc(F)c2c(c1)[nH]nc2)O
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
179.945g/mol
Monoisotopic Mass:
180.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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