Home Halogens 3-bromofuran-2,5-dicarboxylic acid

3-bromofuran-2,5-dicarboxylic acid

CAS No.:
4806-00-2
Catalog Number:
AG01BGCK
Molecular Formula:
C6H3BrO5
Molecular Weight:
234.9890
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Product Description
Catalog Number:
AG01BGCK
Chemical Name:
3-bromofuran-2,5-dicarboxylic acid
CAS Number:
4806-00-2
Molecular Formula:
C6H3BrO5
Molecular Weight:
234.9890
MDL Number:
MFCD28125085
IUPAC Name:
3-bromofuran-2,5-dicarboxylic acid
InChI:
InChI=1S/C6H3BrO5/c7-2-1-3(5(8)9)12-4(2)6(10)11/h1H,(H,8,9)(H,10,11)
InChI Key:
BDMJHLXCYVWBAN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(c(o1)C(=O)O)Br
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.916g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.989g/mol
Monoisotopic Mass:
233.916g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties