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15024-08-5 | Benzoic acid, 4-methyl-, 4-methylphenyl ester
CAS No: 15024-08-5 Catalog No: AG001MFJ MDL No:
Product Description
Catalog Number:
AG001MFJ
Chemical Name:
Benzoic acid, 4-methyl-, 4-methylphenyl ester
CAS Number:
15024-08-5
Molecular Formula:
C15H14O2
Molecular Weight:
226.2705
IUPAC Name:
(4-methylphenyl) 4-methylbenzoate
InChI:
InChI=1S/C15H14O2/c1-11-3-7-13(8-4-11)15(16)17-14-9-5-12(2)6-10-14/h3-10H,1-2H3
InChI Key:
LTTHKDIHUGJTJW-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)OC(=O)c1ccc(cc1)C
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.099g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.275g/mol
Monoisotopic Mass:
226.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
Literature
| Title | Journal |
|---|---|
| 4-Methyl-phenyl 4-bromo-benzoate. | Acta crystallographica. Section E, Structure reports online 20111101 |
| 2,4-Dimethyl-phenyl 4-methyl-benzoate. | Acta crystallographica. Section E, Structure reports online 20091101 |
| Phenyl 4-methyl-benzoate. | Acta crystallographica. Section E, Structure reports online 20091101 |
| 3-Chloro-phenyl 4-methyl-benzoate. | Acta crystallographica. Section E, Structure reports online 20080801 |
| 4-Chloro-phenyl 4-methyl-benzoate. | Acta crystallographica. Section E, Structure reports online 20080801 |
| 2-Methyl-phenyl 4-methyl-benzoate. | Acta crystallographica. Section E, Structure reports online 20080801 |
| 4-Chloro-phenyl 4-chloro-benzoate. | Acta crystallographica. Section E, Structure reports online 20080801 |
| Methyl 4-methyl-benzoate. | Acta crystallographica. Section E, Structure reports online 20080501 |
| 4-Methyl-phenyl 4-chloro-benzoate. | Acta crystallographica. Section E, Structure reports online 20080101 |
| Size-dependent fluorescence of dibenzoylmethanate and ditoluylmethanate of boron difluoride. | Luminescence : the journal of biological and chemical luminescence 20070101 |
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