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101833-09-4 | 2(3H)-Furanone, dihydro-5-methyl-3-phenyl-3-(2-propen-1-yl)-
CAS No: 101833-09-4 Catalog No: AG0005O2 MDL No:
Product Description
Catalog Number:
AG0005O2
Chemical Name:
2(3H)-Furanone, dihydro-5-methyl-3-phenyl-3-(2-propen-1-yl)-
CAS Number:
101833-09-4
Molecular Formula:
C14H16O2
Molecular Weight:
216.2756
IUPAC Name:
5-methyl-3-phenyl-3-prop-2-enyloxolan-2-one
InChI:
InChI=1S/C14H16O2/c1-3-9-14(10-11(2)16-13(14)15)12-7-5-4-6-8-12/h3-8,11H,1,9-10H2,2H3
InChI Key:
QEEZGNLDPXQOOA-UHFFFAOYSA-N
SMILES:
C=CCC1(CC(OC1=O)C)c1ccccc1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.115g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.28g/mol
Monoisotopic Mass:
216.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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