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Home Boronic acids 3-(n-Butylaminocarbonyl)-5-nitrophenylboronic acid

3-(n-Butylaminocarbonyl)-5-nitrophenylboronic acid

CAS No.:
871332-89-7
Catalog Number:
AG008FB7
Molecular Formula:
C11H15BN2O5
Molecular Weight:
266.0582
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
25g
97%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG008FB7
Chemical Name:
3-(n-Butylaminocarbonyl)-5-nitrophenylboronic acid
CAS Number:
871332-89-7
Molecular Formula:
C11H15BN2O5
Molecular Weight:
266.0582
MDL Number:
MFCD07783881
IUPAC Name:
[3-(butylcarbamoyl)-5-nitrophenyl]boronic acid
InChI:
InChI=1S/C11H15BN2O5/c1-2-3-4-13-11(15)8-5-9(12(16)17)7-10(6-8)14(18)19/h5-7,16-17H,2-4H2,1H3,(H,13,15)
InChI Key:
BXFORXWKNBRZNX-UHFFFAOYSA-N
SMILES:
CCCCNC(=O)c1cc(cc(c1)[N+](=O)[O-])B(O)O
Properties
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.107g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
266.06g/mol
Monoisotopic Mass:
266.107g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties