Home Boronic acids 5-BOC-Amino-2-chlorophenylboronic acid pinacol ester

5-BOC-Amino-2-chlorophenylboronic acid pinacol ester

CAS No.:
1080573-28-9
Catalog Number:
AG00949W
Molecular Formula:
C17H25BClNO4
Molecular Weight:
353.6487
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$375
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Product Description
Catalog Number:
AG00949W
Chemical Name:
5-BOC-Amino-2-chlorophenylboronic acid pinacol ester
CAS Number:
1080573-28-9
Molecular Formula:
C17H25BClNO4
Molecular Weight:
353.6487
MDL Number:
MFCD23379564
IUPAC Name:
tert-butyl N-[4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
InChI:
InChI=1S/C17H25BClNO4/c1-15(2,3)22-14(21)20-11-8-9-13(19)12(10-11)18-23-16(4,5)17(6,7)24-18/h8-10H,1-7H3,(H,20,21)
InChI Key:
KFBVAWBHPJEIJX-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(c(c1)B1OC(C(O1)(C)C)(C)C)Cl
Properties
Complexity:
462  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.157g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
353.65g/mol
Monoisotopic Mass:
353.157g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties