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190775-71-4 | Ethanone, 1-(5-benzofuranyl)-
CAS No: 190775-71-4 Catalog No: AG002ETC MDL No:
Product Description
Catalog Number:
AG002ETC
Chemical Name:
Ethanone, 1-(5-benzofuranyl)-
CAS Number:
190775-71-4
Molecular Formula:
C10H8O2
Molecular Weight:
160.1693
IUPAC Name:
1-(1-benzofuran-5-yl)ethanone
InChI:
InChI=1S/C10H8O2/c1-7(11)8-2-3-10-9(6-8)4-5-12-10/h2-6H,1H3
InChI Key:
HKZKHVRQQAJMBP-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc2c(c1)cco2
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.052g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.172g/mol
Monoisotopic Mass:
160.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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