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Home Boronic acids 2-(tert-Butylcarbamoyl)benzylboronic acid

2-(tert-Butylcarbamoyl)benzylboronic acid

CAS No.:
1256345-93-3
Catalog Number:
AG000O0M
Molecular Formula:
C12H18BNO3
Molecular Weight:
235.0872
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
96%
In Stock USA
United States
$125
- +
250mg
96%
In Stock USA
United States
$250
- +
1g
96%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG000O0M
Chemical Name:
2-(tert-Butylcarbamoyl)benzylboronic acid
CAS Number:
1256345-93-3
Molecular Formula:
C12H18BNO3
Molecular Weight:
235.0872
MDL Number:
MFCD16036109
IUPAC Name:
[2-(tert-butylcarbamoyl)phenyl]methylboronic acid
InChI:
InChI=1S/C12H18BNO3/c1-12(2,3)14-11(15)10-7-5-4-6-9(10)8-13(16)17/h4-7,16-17H,8H2,1-3H3,(H,14,15)
InChI Key:
CYSROIZKFPZUBZ-UHFFFAOYSA-N
SMILES:
OB(Cc1ccccc1C(=O)NC(C)(C)C)O
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.138g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
235.09g/mol
Monoisotopic Mass:
235.138g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties