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2096340-00-8 | 3-Methoxy-5-piperidinophenylboronic acid, pinacol ester
CAS No: 2096340-00-8 Catalog No: AG01EHES MDL No:MFCD20441904
Product Description
Catalog Number:
AG01EHES
Chemical Name:
3-Methoxy-5-piperidinophenylboronic acid, pinacol ester
CAS Number:
2096340-00-8
MDL Number:
MFCD20441904
IUPAC Name:
1-[3-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperidine
InChI:
InChI=1S/C18H28BNO3/c1-17(2)18(3,4)23-19(22-17)14-11-15(13-16(12-14)21-5)20-9-7-6-8-10-20/h11-13H,6-10H2,1-5H3
InChI Key:
NHCBWNWRZALISF-UHFFFAOYSA-N
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.216g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.236g/mol
Monoisotopic Mass:
317.216g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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