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Home > Pyridines > 1488005-91-9
1488005-91-9 | 1-(1,3-dihydro-2-benzofuran-5-yl)-2-(pyridin-4-yl)ethan-1-one
CAS No: 1488005-91-9 Catalog No: AG01DVDG MDL No:MFCD20829397
Product Description
Catalog Number:
AG01DVDG
Chemical Name:
1-(1,3-dihydro-2-benzofuran-5-yl)-2-(pyridin-4-yl)ethan-1-one
CAS Number:
1488005-91-9
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
MDL Number:
MFCD20829397
IUPAC Name:
1-(1,3-dihydro-2-benzofuran-5-yl)-2-pyridin-4-ylethanone
InChI:
InChI=1S/C15H13NO2/c17-15(7-11-3-5-16-6-4-11)12-1-2-13-9-18-10-14(13)8-12/h1-6,8H,7,9-10H2
InChI Key:
JFYNLKBXWYLYOJ-UHFFFAOYSA-N
SMILES:
O=C(c1ccc2c(c1)COC2)Cc1ccncc1
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.274g/mol
Monoisotopic Mass:
239.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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