Home Boronic Acids 1021186-08-2
1021186-08-2,MFCD06657902
Catalog No.:AA0006KM
1021186-08-2 | 3-(Piperidin-1-ylmethyl)phenylboronic acid, pinacol ester, HCl
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250mg
97%
in stock  
$39.00   $27.00
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1g
97%
in stock  
$96.00   $67.00
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5g
97%
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$286.00   $200.00
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Technical Information
Catalog Number:
AA0006KM
Chemical Name:
3-(Piperidin-1-ylmethyl)phenylboronic acid, pinacol ester, HCl
CAS Number:
1021186-08-2
Molecular Formula:
C18H29BClNO2
Molecular Weight:
337.6924
MDL Number:
MFCD06657902
IUPAC Name:
1-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]piperidine;hydrochloride
InChI:
InChI=1S/C18H28BNO2.ClH/c1-17(2)18(3,4)22-19(21-17)16-10-8-9-15(13-16)14-20-11-6-5-7-12-20;/h8-10,13H,5-7,11-12,14H2,1-4H3;1H
InChI Key:
DCRYLAICZGZFJF-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cccc(c1)CN1CCCCC1.Cl
Properties
Computed Properties
 
Complexity:
363  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.198g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
337.695g/mol
Monoisotopic Mass:
337.198g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1021186-08-2 
3-(piperidin-1-ylmethyl)phenylboronic acid, pinacol ester, hcl 
OR303546 
X1495 
A-4185 
3-(Piperidin-1-ylmethyl)phenylboronic acid pinacol ester HCl 
3-(piperidin-1-ylmethyl)-phenylboronic acid pinacol ester hydrochloride 
3-(Piperidin-1-ylmethyl)phenylboronic acid pinacol ester hydrochloride 
Piperidinomethyl-3-phenylboronic acid pinacol ester hydrochloride, AldrichCPR 
Piperidine, 1-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]-, hydrochloride (1:1) 
PIPERIDINOMETHYL-3-PHENYLBORONIC ACID PINACOL ESTER HYDROCHLORIDE 
1-(3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZYL)PIPERIDINE HYDROCHLORIDE 
C18H28BNO2.ClH 
SCHEMBL2072274 
DCRYLAICZGZFJF-UHFFFAOYSA-N 
ZX-RL002688 
MFCD06657902 
AKOS022183933 
AB25751 
Literature
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