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79841-40-0 | 2(5H)-Furanone, 3-hydroxy-5-methyl-4-phenyl-
CAS No: 79841-40-0 Catalog No: AG005GQR MDL No:
Product Description
Catalog Number:
AG005GQR
Chemical Name:
2(5H)-Furanone, 3-hydroxy-5-methyl-4-phenyl-
CAS Number:
79841-40-0
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
IUPAC Name:
4-hydroxy-2-methyl-3-phenyl-2H-furan-5-one
InChI:
InChI=1S/C11H10O3/c1-7-9(10(12)11(13)14-7)8-5-3-2-4-6-8/h2-7,12H,1H3
InChI Key:
BULXETQGIFXOJW-UHFFFAOYSA-N
SMILES:
CC1OC(=O)C(=C1c1ccccc1)O
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.063g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.198g/mol
Monoisotopic Mass:
190.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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