Home Boronic acids 2-Chloro-5-(morpholinomethyl)phenylboronic acid, pinacol ester

2-Chloro-5-(morpholinomethyl)phenylboronic acid, pinacol ester

CAS No.:
2096332-48-6
Catalog Number:
AG01EHLA
Molecular Formula:
C17H25BClNO3
Molecular Weight:
337.6493
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$200
- +
5g
95%
In Stock USA
United States
$600
- +
10g
95%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG01EHLA
Chemical Name:
2-Chloro-5-(morpholinomethyl)phenylboronic acid, pinacol ester
CAS Number:
2096332-48-6
Molecular Formula:
C17H25BClNO3
Molecular Weight:
337.6493
MDL Number:
MFCD18783187
IUPAC Name:
4-[[4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine
InChI:
InChI=1S/C17H25BClNO3/c1-16(2)17(3,4)23-18(22-16)14-11-13(5-6-15(14)19)12-20-7-9-21-10-8-20/h5-6,11H,7-10,12H2,1-4H3
InChI Key:
GCHRRPPVKXGTAW-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1B1OC(C(O1)(C)C)(C)C)CN1CCOCC1
Properties
Complexity:
399  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.162g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.651g/mol
Monoisotopic Mass:
337.162g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties