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Home > Boronic Acids > 1449581-03-6
1449581-03-6 | 7-Fluoro-5-Methyl-4-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-1H-Indole
CAS No: 1449581-03-6 Catalog No: AG00HXCI MDL No:MFCD28403736
Product Description
Catalog Number:
AG00HXCI
Chemical Name:
7-Fluoro-5-Methyl-4-(4,4,5,5-Tetramethyl-1,3,2-Dioxaborolan-2-Yl)-1H-Indole
CAS Number:
1449581-03-6
Molecular Formula:
C15H19BFNO2
Molecular Weight:
275.1263
MDL Number:
MFCD28403736
IUPAC Name:
7-fluoro-5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
InChI:
InChI=1S/C15H19BFNO2/c1-9-8-11(17)13-10(6-7-18-13)12(9)16-19-14(2,3)15(4,5)20-16/h6-8,18H,1-5H3
InChI Key:
IZWFOTDZJSENBJ-UHFFFAOYSA-N
SMILES:
Cc1cc(F)c2c(c1B1OC(C(O1)(C)C)(C)C)cc[nH]2
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.149g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.13g/mol
Monoisotopic Mass:
275.149g/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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