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Home Boronic acids 2-Amino-4-(isopropoxycarbonyl)phenylboronic acid, HCl

2-Amino-4-(isopropoxycarbonyl)phenylboronic acid, HCl

CAS No.:
1150114-64-9
Catalog Number:
AG000FMD
Molecular Formula:
C10H15BClNO4
Molecular Weight:
259.4944
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG000FMD
Chemical Name:
2-Amino-4-(isopropoxycarbonyl)phenylboronic acid, HCl
CAS Number:
1150114-64-9
Molecular Formula:
C10H15BClNO4
Molecular Weight:
259.4944
MDL Number:
MFCD12025975
IUPAC Name:
(2-amino-4-propan-2-yloxycarbonylphenyl)boronic acid;hydrochloride
InChI:
InChI=1S/C10H14BNO4.ClH/c1-6(2)16-10(13)7-3-4-8(11(14)15)9(12)5-7;/h3-6,14-15H,12H2,1-2H3;1H
InChI Key:
VMZVJIYHNDCEDU-UHFFFAOYSA-N
SMILES:
CC(OC(=O)c1ccc(c(c1)N)B(O)O)C.Cl
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.078g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
259.493g/mol
Monoisotopic Mass:
259.078g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties