Home Carboxys 7-fluoro-4-methyl-1-benzofuran-2-carboxylic acid

7-fluoro-4-methyl-1-benzofuran-2-carboxylic acid

CAS No.:
1427398-20-6
Catalog Number:
AG01C7DW
Molecular Formula:
C10H7FO3
Molecular Weight:
194.1592
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Product Description
Catalog Number:
AG01C7DW
Chemical Name:
7-fluoro-4-methyl-1-benzofuran-2-carboxylic acid
CAS Number:
1427398-20-6
Molecular Formula:
C10H7FO3
Molecular Weight:
194.1592
MDL Number:
MFCD23708346
IUPAC Name:
7-fluoro-4-methyl-1-benzofuran-2-carboxylic acid
InChI:
InChI=1S/C10H7FO3/c1-5-2-3-7(11)9-6(5)4-8(14-9)10(12)13/h2-4H,1H3,(H,12,13)
InChI Key:
RLYJSALTROJCQG-UHFFFAOYSA-N
SMILES:
OC(=O)c1oc2c(c1)c(C)ccc2F
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