Home Boronic acids 3-(Piperidin-1-ylmethyl)phenylboronic acid, pinacol ester, HCl

3-(Piperidin-1-ylmethyl)phenylboronic acid, pinacol ester, HCl

CAS No.:
1021186-08-2
Catalog Number:
AG0006NE
Molecular Formula:
C18H29BClNO2
Molecular Weight:
337.6924
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$53
- +
1g
96%
In Stock USA
United States
$75
- +
5g
96%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG0006NE
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
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
Properties