Home Other Building Blocks 2-(1-benzofuran-2-yl)propanoic acid

2-(1-benzofuran-2-yl)propanoic acid

CAS No.:
1249571-02-5
Catalog Number:
AG019TZF
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
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Product Description
Catalog Number:
AG019TZF
Chemical Name:
2-(1-benzofuran-2-yl)propanoic acid
CAS Number:
1249571-02-5
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
MDL Number:
MFCD14602275
IUPAC Name:
2-(1-benzofuran-2-yl)propanoic acid
InChI:
InChI=1S/C11H10O3/c1-7(11(12)13)10-6-8-4-2-3-5-9(8)14-10/h2-7H,1H3,(H,12,13)
InChI Key:
LTVQXCJIJREDGA-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1cc2c(o1)cccc2)C
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.063g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.198g/mol
Monoisotopic Mass:
190.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties