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Home > Boronic Acids > 1105665-37-9
1105665-37-9 | 6-isopropylpyridine-3-boronic acid pinacol ester
CAS No: 1105665-37-9 Catalog No: AG0092UM MDL No:MFCD13182161
Product Description
Catalog Number:
AG0092UM
Chemical Name:
6-isopropylpyridine-3-boronic acid pinacol ester
CAS Number:
1105665-37-9
Molecular Formula:
C14H22BNO2
Molecular Weight:
247.1410
MDL Number:
MFCD13182161
IUPAC Name:
2-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C14H22BNO2/c1-10(2)12-8-7-11(9-16-12)15-17-13(3,4)14(5,6)18-15/h7-10H,1-6H3
InChI Key:
VOWCJMHHUBKRHF-UHFFFAOYSA-N
SMILES:
CC(c1cncc(c1)B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.174g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.145g/mol
Monoisotopic Mass:
247.174g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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