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15121-75-2 | 2(5H)-Furanone, 3-methyl-5-phenyl-
CAS No: 15121-75-2 Catalog No: AG001N64 MDL No:MFCD27945144
Product Description
Catalog Number:
AG001N64
Chemical Name:
2(5H)-Furanone, 3-methyl-5-phenyl-
CAS Number:
15121-75-2
Molecular Formula:
C11H10O2
Molecular Weight:
174.1959
MDL Number:
MFCD27945144
IUPAC Name:
4-methyl-2-phenyl-2H-furan-5-one
InChI:
InChI=1S/C11H10O2/c1-8-7-10(13-11(8)12)9-5-3-2-4-6-9/h2-7,10H,1H3
InChI Key:
CLEHNEQZYAGENE-UHFFFAOYSA-N
SMILES:
O=C1OC(C=C1C)c1ccccc1
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.068g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.199g/mol
Monoisotopic Mass:
174.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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