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Home > Boronic Acids > 452972-13-3
452972-13-3 | 3-Bromo-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine
CAS No: 452972-13-3 Catalog No: AG0039FA MDL No:MFCD06798248
Product Description
Catalog Number:
AG0039FA
Chemical Name:
3-Bromo-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine
CAS Number:
452972-13-3
Molecular Formula:
C11H15BBrNO2
Molecular Weight:
283.9573
MDL Number:
MFCD06798248
IUPAC Name:
3-bromo-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C11H15BBrNO2/c1-10(2)11(3,4)16-12(15-10)8-5-9(13)7-14-6-8/h5-7H,1-4H3
InChI Key:
JSUVNRWVYRZAOS-UHFFFAOYSA-N
SMILES:
Brc1cncc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.038g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.96g/mol
Monoisotopic Mass:
283.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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