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Home > Other Building Blocks > 89724-87-8
89724-87-8 | 2(3H)-Furanone, 5-(2,4-dimethylphenyl)-
CAS No: 89724-87-8 Catalog No: AG00430K MDL No:
Product Description
Catalog Number:
AG00430K
Chemical Name:
2(3H)-Furanone, 5-(2,4-dimethylphenyl)-
CAS Number:
89724-87-8
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
IUPAC Name:
5-(2,4-dimethylphenyl)-3H-furan-2-one
InChI:
InChI=1S/C12H12O2/c1-8-3-4-10(9(2)7-8)11-5-6-12(13)14-11/h3-5,7H,6H2,1-2H3
InChI Key:
CLJDXMRNCINERT-UHFFFAOYSA-N
SMILES:
O=C1CC=C(O1)c1ccc(cc1C)C
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.226g/mol
Monoisotopic Mass:
188.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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