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Home Boronic acids 4-(Isopropoxycarbonyl)-2-nitrophenylboronic acid

4-(Isopropoxycarbonyl)-2-nitrophenylboronic acid

CAS No.:
1150114-61-6
Catalog Number:
AG000FMG
Molecular Formula:
C10H12BNO6
Molecular Weight:
253.0164
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG000FMG
Chemical Name:
4-(Isopropoxycarbonyl)-2-nitrophenylboronic acid
CAS Number:
1150114-61-6
Molecular Formula:
C10H12BNO6
Molecular Weight:
253.0164
MDL Number:
MFCD12025972
IUPAC Name:
(2-nitro-4-propan-2-yloxycarbonylphenyl)boronic acid
InChI:
InChI=1S/C10H12BNO6/c1-6(2)18-10(13)7-3-4-8(11(14)15)9(5-7)12(16)17/h3-6,14-15H,1-2H3
InChI Key:
FKPAMQONBPBHMF-UHFFFAOYSA-N
SMILES:
CC(OC(=O)c1ccc(c(c1)[N+](=O)[O-])B(O)O)C
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.076g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.017g/mol
Monoisotopic Mass:
253.076g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties