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Home > Boronic Acids > 1309981-28-9
1309981-28-9 | Pyridine, 2-(1H-pyrrol-1-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1309981-28-9 Catalog No: AG000V91 MDL No:MFCD11878222
Product Description
Catalog Number:
AG000V91
Chemical Name:
Pyridine, 2-(1H-pyrrol-1-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1309981-28-9
Molecular Formula:
C15H19BN2O2
Molecular Weight:
270.1346
MDL Number:
MFCD11878222
IUPAC Name:
2-pyrrol-1-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C15H19BN2O2/c1-14(2)15(3,4)20-16(19-14)12-7-8-13(17-11-12)18-9-5-6-10-18/h5-11H,1-4H3
InChI Key:
BMMJFQOOEZUSGY-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(nc1)n1cccc1
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.154g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.139g/mol
Monoisotopic Mass:
270.154g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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