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Home > Boronic Acids > 269410-27-7
269410-27-7 | N-(2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamide
CAS No: 269410-27-7 Catalog No: AG00BDT9 MDL No:MFCD09878424
Product Description
Catalog Number:
AG00BDT9
Chemical Name:
N-(2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamide
CAS Number:
269410-27-7
Molecular Formula:
C14H19BFNO3
Molecular Weight:
279.1150
MDL Number:
MFCD09878424
IUPAC Name:
N-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide
InChI:
InChI=1S/C14H19BFNO3/c1-9(18)17-12-7-6-10(8-11(12)16)15-19-13(2,3)14(4,5)20-15/h6-8H,1-5H3,(H,17,18)
InChI Key:
LCMXRFQDZUWQLO-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.144g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.118g/mol
Monoisotopic Mass:
279.144g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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