Home Halogens 5-bromo-2-formylfuran-3-carboxylic acid

5-bromo-2-formylfuran-3-carboxylic acid

CAS No.:
1824373-39-8
Catalog Number:
AG01BK9L
Molecular Formula:
C6H3BrO4
Molecular Weight:
218.9896
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Product Description
Catalog Number:
AG01BK9L
Chemical Name:
5-bromo-2-formylfuran-3-carboxylic acid
CAS Number:
1824373-39-8
Molecular Formula:
C6H3BrO4
Molecular Weight:
218.9896
MDL Number:
MFCD24485479
IUPAC Name:
5-bromo-2-formylfuran-3-carboxylic acid
InChI:
InChI=1S/C6H3BrO4/c7-5-1-3(6(9)10)4(2-8)11-5/h1-2H,(H,9,10)
InChI Key:
WZXLZJYEHOSMLQ-UHFFFAOYSA-N
SMILES:
O=Cc1oc(cc1C(=O)O)Br
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.921g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.99g/mol
Monoisotopic Mass:
217.921g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties