Home Boronic acids 3-(Dimethylcarbamoyl)-5-nitrophenylboronic acid

3-(Dimethylcarbamoyl)-5-nitrophenylboronic acid

CAS No.:
874219-44-0
Catalog Number:
AG004G73
Molecular Formula:
C9H11BN2O5
Molecular Weight:
238.0050
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$188
- +
25g
98%
In Stock USA
United States
$375
- +
100g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG004G73
Chemical Name:
3-(Dimethylcarbamoyl)-5-nitrophenylboronic acid
CAS Number:
874219-44-0
Molecular Formula:
C9H11BN2O5
Molecular Weight:
238.0050
MDL Number:
MFCD08235061
IUPAC Name:
[3-(dimethylcarbamoyl)-5-nitrophenyl]boronic acid
InChI:
InChI=1S/C9H11BN2O5/c1-11(2)9(13)6-3-7(10(14)15)5-8(4-6)12(16)17/h3-5,14-15H,1-2H3
InChI Key:
CMEDBCAYQJUDQF-UHFFFAOYSA-N
SMILES:
OB(c1cc(cc(c1)[N+](=O)[O-])C(=O)N(C)C)O
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.076g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
238.006g/mol
Monoisotopic Mass:
238.076g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties