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Home > Boronic Acids > 2096334-57-3
2096334-57-3 | 2-Chloro-4-(piperidinomethyl)phenylboronic acid, pinacol ester
CAS No: 2096334-57-3 Catalog No: AG01EHN5 MDL No:MFCD18311894
Product Description
Catalog Number:
AG01EHN5
Chemical Name:
2-Chloro-4-(piperidinomethyl)phenylboronic acid, pinacol ester
CAS Number:
2096334-57-3
MDL Number:
MFCD18311894
IUPAC Name:
1-[[3-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]piperidine
InChI:
InChI=1S/C18H27BClNO2/c1-17(2)18(3,4)23-19(22-17)15-9-8-14(12-16(15)20)13-21-10-6-5-7-11-21/h8-9,12H,5-7,10-11,13H2,1-4H3
InChI Key:
CVDVNNLDNFYLRP-UHFFFAOYSA-N
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.182g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.679g/mol
Monoisotopic Mass:
335.182g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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