Home Carboxys 5-ethyl-2,3-dihydro-1-benzofuran-7-carboxylic acid

5-ethyl-2,3-dihydro-1-benzofuran-7-carboxylic acid

CAS No.:
108551-59-3
Catalog Number:
AG01DXA9
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
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Product Description
Catalog Number:
AG01DXA9
Chemical Name:
5-ethyl-2,3-dihydro-1-benzofuran-7-carboxylic acid
CAS Number:
108551-59-3
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD20654685
IUPAC Name:
5-ethyl-2,3-dihydro-1-benzofuran-7-carboxylic acid
InChI:
InChI=1S/C11H12O3/c1-2-7-5-8-3-4-14-10(8)9(6-7)11(12)13/h5-6H,2-4H2,1H3,(H,12,13)
InChI Key:
CBEHCCOHAWHFCL-UHFFFAOYSA-N
SMILES:
CCc1cc2CCOc2c(c1)C(=O)O
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.214g/mol
Monoisotopic Mass:
192.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties