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1459-93-4 | 1,3-Benzenedicarboxylic acid, 1,3-dimethyl ester
CAS No: 1459-93-4 Catalog No: AG001DI7 MDL No:MFCD00008433
Product Description
Catalog Number:
AG001DI7
Chemical Name:
1,3-Benzenedicarboxylic acid, 1,3-dimethyl ester
CAS Number:
1459-93-4
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
MDL Number:
MFCD00008433
IUPAC Name:
dimethyl benzene-1,3-dicarboxylate
InChI:
InChI=1S/C10H10O4/c1-13-9(11)7-4-3-5-8(6-7)10(12)14-2/h3-6H,1-2H3
InChI Key:
VNGOYPQMJFJDLV-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)C(=O)OC
EC Number:
215-951-9
UNII:
2UY9Y3574K
NSC Number:
15313
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.186g/mol
Monoisotopic Mass:
194.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Degradation of Phthalate Esters by Fusarium sp. DMT-5-3 and Trichosporon sp. DMI-5-1 Isolated from Mangrove Sediments. | Progress in molecular and subcellular biology 20120101 |
| The diversity of endophytic methylotrophic bacteria in an oil-contaminated and an oil-free mangrove ecosystem and their tolerance to heavy metals. | Biotechnology research international 20120101 |
| A novel alkaline esterase from Sporosarcina sp. nov. strain eSP04 catalyzing the hydrolysis of a wide variety of aryl-carboxylic acid esters. | Bioscience, biotechnology, and biochemistry 20120101 |
| Comparison of initial hydrolysis of the three dimethyl phthalate esters (DMPEs) by a basidiomycetous yeast, Trichosporon DMI-5-1, from coastal sediment. | Environmental science and pollution research international 20111101 |
| Release kinetics of β-cyfluthrin from its encapsulated formulations in water. | Journal of environmental science and health. Part. B, Pesticides, food contaminants, and agricultural wastes 20110101 |
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Peripherally dimethyl isophthalate-functionalized poly(benzyl ether) dendrons: a new kind of unprecedented highly efficient organogelators. | Journal of the American Chemical Society 20090617 |
| Environmental fate of endocrine-disrupting dimethyl phthalate esters (DMPE) under sulfate-reducing condition. | The Science of the total environment 20070801 |
| Complete degradation of dimethyl isophthalate requires the biochemical cooperation between Klebsiella oxytoca Sc and Methylobacterium mesophilicum Sr Isolated from Wetland sediment. | The Science of the total environment 20070715 |
| Electrocarboxylation of benzyl halides through redox catalysis on the preparative scale. | Chemistry (Weinheim an der Bergstrasse, Germany) 20060925 |
| Biochemical pathway and degradation of phthalate ester isomers by bacteria. | Water science and technology : a journal of the International Association on Water Pollution Research 20050101 |
| Thermodynamics of complexation of dimethyl esters of tere-, iso-, and phthalic acids with alpha- and beta-cyclodextrins. | Applied spectroscopy 20040701 |
| [Polyethylene terephthalate (PET)--health aspects and food packaging application]. | Roczniki Panstwowego Zakladu Higieny 20030101 |
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