3'-Methylphthalanilic acid

Base Information

• Chemical Name: 3'-Methylphthalanilic acid
• CAS No.: 85-72-3
• Molecular Formula: C15H13NO3
• Molecular Weight: 255.273
• Hs Code.: 2924299090
• European Community (EC) Number: 201-626-9
• NSC Number: 522078
• UNII: 3R15BUY339
• DSSTox Substance ID: DTXSID0041486
• Nikkaji Number: J4.922K
• Wikidata: Q27257922
• ChEMBL ID: CHEMBL1588580
• Mol file: 85-72-3.mol

Synonyms:3'-Methylphthalanilic acid;N-m-Tolylphthalamic acid;85-72-3;Tomaset;DURASET;Phthalamate;2-(m-tolylcarbamoyl)benzoic acid;Duraset 20W;Phthalanilic acid, 3'-methyl-;N-m-Tolylphthalaminic acid;N-Metatolyl phthalamic acid;N-M-T;N-meta-Tolylphthalamic acid;2-[(3-methylphenyl)carbamoyl]benzoic acid;Caswell No. 860;Kyselina N-m-tolylftalamova;NSC 522078;EINECS 201-626-9;Kyselina N-m-tolylftalamova [Czech];2-(((3-Methylphenyl)amino)carbonyl)benzoic acid;EPA Pesticide Chemical Code 030901;BRN 2698092;Benzoic acid, 2-[[(3-methylphenyl)amino]carbonyl]-;N-(meta-Tolyl)phthalamic acid;UNII-3R15BUY339;AI3-23601;3R15BUY339;Benzoic acid, 2-(((3-methylphenyl)amino)carbonyl)-;MFCD00020274;NSC-522078;2-{[(3-methylphenyl)amino]carbonyl}benzoic acid;0-12-00-00862 (Beilstein Handbook Reference);C15H13NO3;2-[[(3-methylphenyl)amino]carbonyl]benzoic acid;2-(3-Methylphenylcarbamoyl)benzoic acid;WLN: QVR BVMR C;3/'-Methylphthalanilic acid;Oprea1_465165;MLS000058802;SCHEMBL3356211;CHEMBL1588580;DTXSID0041486;HMS1578M16;HMS2414E11;N-(3-Methylphenyl)phthalamidic acid;2-(3-Toluidinocarbonyl)benzoic acid;NSC522078;AKOS001381771;2-(3-Toluidinocarbonyl)benzoic acid #;SDCCGMLS-0038971.P002;3'-METHYLPHTHALANILIC ACID [MI];SMR000069068;LS-109104;CS-0281035;EU-0000539;FT-0616174;2-[[(3-methylphenyl)amino]carbonyl]benzoesyre;AB00390459-09;SR-01000392380;SR-01000392380-1;Q27257922;Z57434612;[2,3,5,6-tetrafluoro-4-(methoxymethyl)phenyl]methyl2,2-dimethyl-3-prop-1-enyl-cyclopropane-1-carboxylate

Chemical Property of 3'-Methylphthalanilic acid

Chemical Property:

• Melting Point: 150 ºC
• Boiling Point: 371 °C at 760 mmHg
• PKA: 3.46±0.36(Predicted)
• Flash Point: 178.2 °C
• PSA: 66.40000
• Density: 1.295 g/cm³
• LogP: 3.01850
• Storage Temp.: -20°C Freezer
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 255.08954328
• Heavy Atom Count: 19
• Complexity: 342

Purity/Quality:

≥97.0% ^*data from raw suppliers

N-M-TolylphthalamicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,N
• Hazard Codes: Xi,N
• Statements: 36-50
• Safety Statements: 26-61

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2C(=O)O
• Uses: In agriculture as an antiscission agent for fruitsand vegetables. N-M-Tolylphthalamic Acid is used to prevent premature drop an anti shock treatment for pants. On ingestion is hydrolyzed to produce m-toluidine

Technology Process of 3'-Methylphthalanilic acid

There total 4 articles about 3'-Methylphthalanilic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

phthalic anhydride (85-44-9) + 1-amino-3-methylbenzene (108-44-1) → N-meta-tolyl phthalamic acid (85-72-3)

Guidance literature:

man erwaermt das erhaltene N-m-Tolyl-phthalimid mit 10prozentiger Natronlauge;

Reference yield:

benzene-1,2-dicarboxylic acid (88-99-3,73607-73-5) + 1-amino-3-methylbenzene (108-44-1) → N-meta-tolyl phthalamic acid (85-72-3)

Guidance literature:

man erwaermt das erhaltene N-m-Tolyl-phthalimid mit 10prozentiger Natronlauge;

Reference yield:

N-(3-methylphenyl)phthalimide (2314-76-3) + furan-2,3,5(4H)-trione pyridine (1:1) → N-meta-tolyl phthalamic acid (85-72-3)

Guidance literature:

upstream raw materials:

phthalic anhydride

1-amino-3-methylbenzene

N-(3-methylphenyl)phthalimide

benzene-1,2-dicarboxylic acid

Downstream raw materials:

N-(3-methylphenyl)phthalimide

Refernces

Chemical constituents of Diospyros buxifolia, D. tomentosa, D. ferra, D. lotus, Rhus parviflora, Polygonum recumbens, Balanites aegyptiaca and Pyrus pashia

10.1016/S0031-9422(00)97297-2

This research aimed to identify and isolate the chemical constituents of various plant species, including Diospyros buxifolia, D. tomentosa, D. ferra, D. lotus, Balanites aegyptiaca, Rhus parviflora, Polygonum recumbens, and Pyrus pashia. The study involved the extraction and chromatographic separation of compounds from these plants, leading to the identification of various triterpenes, steroids, and other chemical constituents such as friedelin, epi-friedelinol, p-sitosterol, lupeol, betulin, betulinic acid, and maslinic acid, among others. The research concluded with the detailed characterization of these compounds, including their melting points, optical rotations, and spectroscopic data, which contribute to the understanding of the phytochemical profiles of the studied plants and may have implications for their medicinal properties.

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