Home Carboxys 5-Fluoro-3-methylbenzofuran-2-carboxylic acid

5-Fluoro-3-methylbenzofuran-2-carboxylic acid

CAS No.:
81718-76-5
Catalog Number:
AG00518O
Molecular Formula:
C10H7FO3
Molecular Weight:
194.1592
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Product Description
Catalog Number:
AG00518O
Chemical Name:
5-Fluoro-3-methylbenzofuran-2-carboxylic acid
CAS Number:
81718-76-5
Molecular Formula:
C10H7FO3
Molecular Weight:
194.1592
MDL Number:
MFCD04448734
IUPAC Name:
5-fluoro-3-methyl-1-benzofuran-2-carboxylic acid
InChI:
InChI=1S/C10H7FO3/c1-5-7-4-6(11)2-3-8(7)14-9(5)10(12)13/h2-4H,1H3,(H,12,13)
InChI Key:
GMIDGDXRCTUPNM-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)c(C)c(o2)C(=O)O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.161g/mol
Monoisotopic Mass:
194.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties