Home Carboxys 3-Bromo-4,5-dihydroisoxazole-5-carboxylic acid amide

3-Bromo-4,5-dihydroisoxazole-5-carboxylic acid amide

CAS No.:
1030613-69-4
Catalog Number:
AG008TYL
Molecular Formula:
C4H5BrN2O2
Molecular Weight:
192.9987
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$150
- +
1g
96%
In Stock USA
United States
$300
- +
5g
96%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG008TYL
Chemical Name:
3-Bromo-4,5-dihydroisoxazole-5-carboxylic acid amide
CAS Number:
1030613-69-4
Molecular Formula:
C4H5BrN2O2
Molecular Weight:
192.9987
MDL Number:
MFCD11707008
IUPAC Name:
3-bromo-4,5-dihydro-1,2-oxazole-5-carboxamide
InChI:
InChI=1S/C4H5BrN2O2/c5-3-1-2(4(6)8)9-7-3/h2H,1H2,(H2,6,8)
InChI Key:
NVMBOQJWLFNIMK-UHFFFAOYSA-N
SMILES:
NC(=O)C1CC(=NO1)Br
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.953g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193g/mol
Monoisotopic Mass:
191.953g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties