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Home > Boronic Acids > 1313040-65-1
1313040-65-1 | 4-Piperidinol, 1-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-
CAS No: 1313040-65-1 Catalog No: AG000VWV MDL No:MFCD09607676
Product Description
Catalog Number:
AG000VWV
Chemical Name:
4-Piperidinol, 1-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-
CAS Number:
1313040-65-1
Molecular Formula:
C16H25BN2O3
Molecular Weight:
304.1923
MDL Number:
MFCD09607676
IUPAC Name:
1-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperidin-4-ol
InChI:
InChI=1S/C16H25BN2O3/c1-15(2)16(3,4)22-17(21-15)13-6-5-7-14(18-13)19-10-8-12(20)9-11-19/h5-7,12,20H,8-11H2,1-4H3
InChI Key:
VQTRYULJANQBCI-UHFFFAOYSA-N
SMILES:
OC1CCN(CC1)c1cccc(n1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.196g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.197g/mol
Monoisotopic Mass:
304.196g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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