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Home > Boronic Acids > 1165936-00-4
1165936-00-4 | 1,3,2-Dioxaborolane, 2-(2-fluoro-3-methoxyphenyl)-4,4,5,5-tetramethyl-
CAS No: 1165936-00-4 Catalog No: AG000CU0 MDL No:MFCD16618962
Product Description
Catalog Number:
AG000CU0
Chemical Name:
1,3,2-Dioxaborolane, 2-(2-fluoro-3-methoxyphenyl)-4,4,5,5-tetramethyl-
CAS Number:
1165936-00-4
Molecular Formula:
C13H18BFO3
Molecular Weight:
252.0896
MDL Number:
MFCD16618962
IUPAC Name:
2-(2-fluoro-3-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BFO3/c1-12(2)13(3,4)18-14(17-12)9-7-6-8-10(16-5)11(9)15/h6-8H,1-5H3
InChI Key:
MALXDJBHSGDLGF-UHFFFAOYSA-N
SMILES:
COc1cccc(c1F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.133g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.092g/mol
Monoisotopic Mass:
252.133g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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