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Home > Boronic Acids > 1326316-85-1
1326316-85-1 | 1,3,2-Dioxaborolane, 2-(4-bromo-2-fluorophenyl)-4,4,5,5-tetramethyl-
CAS No: 1326316-85-1 Catalog No: AG0010X7 MDL No:MFCD22494116
Product Description
Catalog Number:
AG0010X7
Chemical Name:
1,3,2-Dioxaborolane, 2-(4-bromo-2-fluorophenyl)-4,4,5,5-tetramethyl-
CAS Number:
1326316-85-1
Molecular Formula:
C12H15BBrFO2
Molecular Weight:
300.9597
MDL Number:
MFCD22494116
IUPAC Name:
2-(4-bromo-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H15BBrFO2/c1-11(2)12(3,4)17-13(16-11)9-6-5-8(14)7-10(9)15/h5-7H,1-4H3
InChI Key:
YCGVIJBHBZUTTM-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.033g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.962g/mol
Monoisotopic Mass:
300.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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