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131939-13-4 | 2(5H)-Furanone, 4-methoxy-5-methylene-3-(1-oxodecyl)-
CAS No: 131939-13-4 Catalog No: AG000ZY5 MDL No:
Product Description
Catalog Number:
AG000ZY5
Chemical Name:
2(5H)-Furanone, 4-methoxy-5-methylene-3-(1-oxodecyl)-
CAS Number:
131939-13-4
Molecular Formula:
C16H24O4
Molecular Weight:
280.3594
IUPAC Name:
3-decanoyl-4-methoxy-5-methylidenefuran-2-one
InChI:
InChI=1S/C16H24O4/c1-4-5-6-7-8-9-10-11-13(17)14-15(19-3)12(2)20-16(14)18/h2,4-11H2,1,3H3
InChI Key:
YOBPYXQSWRGHFF-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(=O)C1=C(OC)C(=C)OC1=O
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.167g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.364g/mol
Monoisotopic Mass:
280.167g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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