Home Other Building Blocks 5-BROMO-3-ETHYL-1-BENZOFURAN-2-CARBOXYLIC ACID

5-BROMO-3-ETHYL-1-BENZOFURAN-2-CARBOXYLIC ACID

CAS No.:
86793-66-0
Catalog Number:
AG01DWR0
Molecular Formula:
C11H9BrO3
Molecular Weight:
269.0914
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Product Description
Catalog Number:
AG01DWR0
Chemical Name:
5-BROMO-3-ETHYL-1-BENZOFURAN-2-CARBOXYLIC ACID
CAS Number:
86793-66-0
Molecular Formula:
C11H9BrO3
Molecular Weight:
269.0914
MDL Number:
MFCD16742968
IUPAC Name:
5-bromo-3-ethyl-1-benzofuran-2-carboxylic acid
InChI:
InChI=1S/C11H9BrO3/c1-2-7-8-5-6(12)3-4-9(8)15-10(7)11(13)14/h3-5H,2H2,1H3,(H,13,14)
InChI Key:
FTQXVWZXFFMHDP-UHFFFAOYSA-N
SMILES:
CCc1c(oc2c1cc(Br)cc2)C(=O)O
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.974g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.094g/mol
Monoisotopic Mass:
267.974g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties