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Home > Boronic Acids > 1072952-24-9
1072952-24-9 | 2-(Piperidino)phenylboronic acid HCl
CAS No: 1072952-24-9 Catalog No: AG00HAYV MDL No:
Product Description
Catalog Number:
AG00HAYV
Chemical Name:
2-(Piperidino)phenylboronic acid HCl
CAS Number:
1072952-24-9
Molecular Formula:
C11H17BClNO2
Molecular Weight:
241.5222
IUPAC Name:
(2-piperidin-1-ylphenyl)boronic acid;hydrochloride
InChI:
InChI=1S/C11H16BNO2.ClH/c14-12(15)10-6-2-3-7-11(10)13-8-4-1-5-9-13;/h2-3,6-7,14-15H,1,4-5,8-9H2;1H
InChI Key:
YEFAUFFZXBJFLF-UHFFFAOYSA-N
SMILES:
OB(c1ccccc1N1CCCCC1)O.Cl
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.104g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
241.522g/mol
Monoisotopic Mass:
241.104g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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