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Home > Boronic Acids > 890839-37-9
890839-37-9 | 3,5-Difluoro-4-Methoxybenzeneboronic acid pinacol ester, 96%
CAS No: 890839-37-9 Catalog No: AG00H1QC MDL No:MFCD22414481
Product Description
Catalog Number:
AG00H1QC
Chemical Name:
3,5-Difluoro-4-Methoxybenzeneboronic acid pinacol ester, 96%
CAS Number:
890839-37-9
Molecular Formula:
C13H17BF2O3
Molecular Weight:
270.0801
MDL Number:
MFCD22414481
IUPAC Name:
2-(3,5-difluoro-4-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H17BF2O3/c1-12(2)13(3,4)19-14(18-12)8-6-9(15)11(17-5)10(16)7-8/h6-7H,1-5H3
InChI Key:
LVDNSBZUAAXPPZ-UHFFFAOYSA-N
SMILES:
COc1c(F)cc(cc1F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.124g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.083g/mol
Monoisotopic Mass:
270.124g/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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