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129887-32-7 | 2(5H)-Furanone, 5-hydroxy-5-(4-methylphenyl)-
CAS No: 129887-32-7 Catalog No: AG000TRW MDL No:
Product Description
Catalog Number:
AG000TRW
Chemical Name:
2(5H)-Furanone, 5-hydroxy-5-(4-methylphenyl)-
CAS Number:
129887-32-7
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
IUPAC Name:
5-hydroxy-5-(4-methylphenyl)furan-2-one
InChI:
InChI=1S/C11H10O3/c1-8-2-4-9(5-3-8)11(13)7-6-10(12)14-11/h2-7,13H,1H3
InChI Key:
MMCNOZZQNBBNKZ-UHFFFAOYSA-N
SMILES:
O=C1C=CC(O1)(O)c1ccc(cc1)C
Properties
Complexity:
264
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:
1.5
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