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Home > Boronic Acids > 1015242-01-9
1015242-01-9 | 2-(4-cyclopentyl -piperazin-1-yl) pyridine-5-boronic acid pinacol ester
CAS No: 1015242-01-9 Catalog No: AG0098Z8 MDL No:MFCD13191365
Product Description
Catalog Number:
AG0098Z8
Chemical Name:
2-(4-cyclopentyl -piperazin-1-yl) pyridine-5-boronic acid pinacol ester
CAS Number:
1015242-01-9
Molecular Formula:
C20H32BN3O2
Molecular Weight:
357.2980
MDL Number:
MFCD13191365
IUPAC Name:
1-cyclopentyl-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine
InChI:
InChI=1S/C20H32BN3O2/c1-19(2)20(3,4)26-21(25-19)16-9-10-18(22-15-16)24-13-11-23(12-14-24)17-7-5-6-8-17/h9-10,15,17H,5-8,11-14H2,1-4H3
InChI Key:
AWVHJAMXEPONJS-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(nc1)N1CCN(CC1)C1CCCC1
Properties
Complexity:
471
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.259g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
357.305g/mol
Monoisotopic Mass:
357.259g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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