Home Boronic acids 3-Chloro-5-pyrrolidinophenylboronic acid, pinacol ester

3-Chloro-5-pyrrolidinophenylboronic acid, pinacol ester

CAS No.:
2096331-84-7
Catalog Number:
AG01EHL0
Molecular Formula:
C16H23BClNO2
Molecular Weight:
307.6233
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$150
- +
5g
96%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG01EHL0
Chemical Name:
3-Chloro-5-pyrrolidinophenylboronic acid, pinacol ester
CAS Number:
2096331-84-7
Molecular Formula:
C16H23BClNO2
Molecular Weight:
307.6233
MDL Number:
MFCD18783182
IUPAC Name:
1-[3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyrrolidine
InChI:
InChI=1S/C16H23BClNO2/c1-15(2)16(3,4)21-17(20-15)12-9-13(18)11-14(10-12)19-7-5-6-8-19/h9-11H,5-8H2,1-4H3
InChI Key:
SPJAKXDVRKVFKV-UHFFFAOYSA-N
SMILES:
Clc1cc(cc(c1)N1CCCC1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
369  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.151g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.625g/mol
Monoisotopic Mass:
307.151g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties