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66971-98-0 | 6-(2-Pentenyl)-3-(2-pyridinylsulfinyl)tetrahydro-2H-pyran-2-one
CAS No: 66971-98-0 Catalog No: AG00FY2M MDL No:
Product Description
Catalog Number:
AG00FY2M
Chemical Name:
6-(2-Pentenyl)-3-(2-pyridinylsulfinyl)tetrahydro-2H-pyran-2-one
CAS Number:
66971-98-0
IUPAC Name:
6-[(E)-pent-2-enyl]-3-pyridin-2-ylsulfinyloxan-2-one
InChI:
InChI=1S/C15H19NO3S/c1-2-3-4-7-12-9-10-13(15(17)19-12)20(18)14-8-5-6-11-16-14/h3-6,8,11-13H,2,7,9-10H2,1H3/b4-3+
InChI Key:
BJMJNQDACXAHDO-ONEGZZNKSA-N
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
293.109g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.381g/mol
Monoisotopic Mass:
293.109g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
75.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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