Home Halogens Dimethyl 2-bromo-1h-imidazole-4,5-dicarboxylate

Dimethyl 2-bromo-1h-imidazole-4,5-dicarboxylate

CAS No.:
705280-65-5
Catalog Number:
AG00FAYL
Molecular Formula:
C7H7BrN2O4
Molecular Weight:
263.0455
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$200
- +
5g
96%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00FAYL
Chemical Name:
Dimethyl 2-bromo-1h-imidazole-4,5-dicarboxylate
CAS Number:
705280-65-5
Molecular Formula:
C7H7BrN2O4
Molecular Weight:
263.0455
MDL Number:
MFCD09702026
IUPAC Name:
dimethyl 2-bromo-1H-imidazole-4,5-dicarboxylate
InChI:
InChI=1S/C7H7BrN2O4/c1-13-5(11)3-4(6(12)14-2)10-7(8)9-3/h1-2H3,(H,9,10)
InChI Key:
JMXUWJPKHDKROF-UHFFFAOYSA-N
SMILES:
COC(=O)c1[nH]c(nc1C(=O)OC)Br
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.959g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
263.047g/mol
Monoisotopic Mass:
261.959g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
81.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties