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Home > Boronic Acids > 1256358-98-1
1256358-98-1 | 6-Fluoro-1h-indole-2-boronic acid pinacol ester
CAS No: 1256358-98-1 Catalog No: AG009VGT MDL No:MFCD11858391
Product Description
Catalog Number:
AG009VGT
Chemical Name:
6-Fluoro-1h-indole-2-boronic acid pinacol ester
CAS Number:
1256358-98-1
Molecular Formula:
C14H17BFNO2
Molecular Weight:
261.0997
MDL Number:
MFCD11858391
IUPAC Name:
6-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
InChI:
InChI=1S/C14H17BFNO2/c1-13(2)14(3,4)19-15(18-13)12-7-9-5-6-10(16)8-11(9)17-12/h5-8,17H,1-4H3
InChI Key:
ZHTMYMRIYSNMNH-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)[nH]c(c2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.134g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.103g/mol
Monoisotopic Mass:
261.134g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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