Home Halogens 3-Furancarboxylic acid, 2-bromo-

3-Furancarboxylic acid, 2-bromo-

CAS No.:
197846-05-2
Catalog Number:
AG002B44
Molecular Formula:
C5H3BrO3
Molecular Weight:
190.9795
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Product Description
Catalog Number:
AG002B44
Chemical Name:
3-Furancarboxylic acid, 2-bromo-
CAS Number:
197846-05-2
Molecular Formula:
C5H3BrO3
Molecular Weight:
190.9795
MDL Number:
MFCD09702417
IUPAC Name:
2-bromofuran-3-carboxylic acid
InChI:
InChI=1S/C5H3BrO3/c6-4-3(5(7)8)1-2-9-4/h1-2H,(H,7,8)
InChI Key:
UJNWWTUUYCCIFL-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccoc1Br
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.927g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.98g/mol
Monoisotopic Mass:
189.927g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties