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Home Boronic acids 3-(N,N-Diethylaminocarbonyl)-5-nitrophenylboronic acid

3-(N,N-Diethylaminocarbonyl)-5-nitrophenylboronic acid

CAS No.:
871332-82-0
Catalog Number:
AG004TVF
Molecular Formula:
C11H15BN2O5
Molecular Weight:
266.0582
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$158
- +
5g
98%
In Stock USA
United States
$630
- +
Product Description
Catalog Number:
AG004TVF
Chemical Name:
3-(N,N-Diethylaminocarbonyl)-5-nitrophenylboronic acid
CAS Number:
871332-82-0
Molecular Formula:
C11H15BN2O5
Molecular Weight:
266.0582
MDL Number:
MFCD07783874
IUPAC Name:
[3-(diethylcarbamoyl)-5-nitrophenyl]boronic acid
InChI:
InChI=1S/C11H15BN2O5/c1-3-13(4-2)11(15)8-5-9(12(16)17)7-10(6-8)14(18)19/h5-7,16-17H,3-4H2,1-2H3
InChI Key:
BSSTYJYXCIVGHB-UHFFFAOYSA-N
SMILES:
CCN(C(=O)c1cc(cc(c1)[N+](=O)[O-])B(O)O)CC
Properties
Complexity:
330  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
266.06g/mol
Monoisotopic Mass:
266.107g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties