Home Other Building Blocks 2-(2-methyl-1-benzofuran-3-yl)acetic acid

2-(2-methyl-1-benzofuran-3-yl)acetic acid

CAS No.:
99846-06-7
Catalog Number:
AG01A6ZW
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
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Product Description
Catalog Number:
AG01A6ZW
Chemical Name:
2-(2-methyl-1-benzofuran-3-yl)acetic acid
CAS Number:
99846-06-7
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
MDL Number:
MFCD00015462
IUPAC Name:
2-(2-methyl-1-benzofuran-3-yl)acetic acid
InChI:
InChI=1S/C11H10O3/c1-7-9(6-11(12)13)8-4-2-3-5-10(8)14-7/h2-5H,6H2,1H3,(H,12,13)
InChI Key:
QTNNBXQGXZPWOD-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c(C)oc2c1cccc2
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties