1-(2-Carboxyphenyl)-3,3-dimethyltriazene

Base Information

• Chemical Name: 1-(2-Carboxyphenyl)-3,3-dimethyltriazene
• CAS No.: 20119-28-2
• Molecular Formula: C9H11N3O2
• Molecular Weight: 193.205
• Hs Code.: 2916399090
• European Community (EC) Number: 243-523-1
• NSC Number: 140114,226088,210718
• UNII: MEP5DE3GSW
• DSSTox Substance ID: DTXSID401261156
• Nikkaji Number: J280.448D
• ChEMBL ID: CHEMBL45910
• Mol file: 20119-28-2.mol

Synonyms:20119-28-2;3,3-Dimethyl-1-(2-carboxyphenyl)triazene;1-(2-Carboxyphenyl)-3,3-dimethyltriazene;2-(dimethyltriaz-1-en-1-yl)benzoic acid;2-(dimethylaminodiazenyl)benzoic acid;1071638-58-8;MEP5DE3GSW;2-(3,3-Dimethyltriazen-1-yl)benzoic acid;Benzoic acid, o-(3,3-dimethyl-1-triazeno)-;Benzoic acid, 2-(3,3-dimethyl-1-triazenyl)-;EINECS 243-523-1;NSC 140114;NSC-140114;NSC-210718;NSC-226088;BENZOIC ACID, 2-(3,3-DIMETHYL-1-TRIAZEN-1-YL)-;2-(3,3-Dimethyl-1-triazen-1-yl)benzoic acid;4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(2,2-dimethyl-1-oxopropyl)amino]-3,3-dimethyl-7-oxo-, monosodium salt, [2S-(2alpha,5alpha,6beta)]- (9CI);2-[(1E)-3,3-Dimethyl-1-triazenyl]benzoic acid;UNII-MEP5DE3GSW;CHEMBL45910;SCHEMBL3412059;DTXSID401261156;Dimethylaminoazobenzol-o-carbonsaure;MFCD00013975;NSC140114;NSC210718;NSC226088;AKOS000121532;AKOS025116961;2-(dimethyltriaz-1-en-1-yl)benzoicacid;2-(3,3-Dimethyl-1-triazenyl)benzoic acid;CS-0235896;FT-0614065;EN300-16458;2-(3,3-dimethyltriaz-1-en-1-yl)benzoic acid;(E)-2-(3,3-dimethyltriaz-1-enyl)benzoic acid;2-[(1E)-3,3-Dimethyl-1-triazenyl]benzoic acid #;Z55928822

Chemical Property of 1-(2-Carboxyphenyl)-3,3-dimethyltriazene

Chemical Property:

• Vapor Pressure: 7.64E-05mmHg at 25°C
• Melting Point: 124-126oC
• Boiling Point: 328.5°Cat760mmHg
• Flash Point: 152.4°C
• PSA: 65.26000
• Density: 1.19g/cm³
• LogP: 1.94510
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 193.085126602
• Heavy Atom Count: 14
• Complexity: 228

Purity/Quality:

99% ^*data from raw suppliers

3,3-Dimethyl-1-(2-carboxyphenyl)triazene ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CN(C)N=NC1=CC=CC=C1C(=O)O

Technology Process of 1-(2-Carboxyphenyl)-3,3-dimethyltriazene

There total 9 articles about 1-(2-Carboxyphenyl)-3,3-dimethyltriazene 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: 100.0%

benzenedizolium-2-carboxylate (1608-42-0) + dimethyl amine (124-40-3) → 2-(3,3-dimethyltriazen-1-yl)benzoic acid (20119-28-2)

Guidance literature:

In tetrahydrofuran; Reflux;

DOI:10.1246/bcsj.20100266

Reference yield:

2-carboxybenzene diazonium chloride (4661-46-5) + dimethyl amine (124-40-3) → 2-(3,3-dimethyltriazen-1-yl)benzoic acid (20119-28-2)

Guidance literature:

In dichloromethane; at 0 ℃; for 1h; Yield given;

DOI:10.1016/0040-4020(95)00115-O

Reference yield:

anthranilic acid (118-92-3,159201-01-1,50816-84-7,80206-34-4,104809-47-4) → 2-(3,3-dimethyltriazen-1-yl)benzoic acid (20119-28-2)

Guidance literature:

Multi-step reaction with 2 steps

1: NO₂ / 6 h / 0 °C

2: Ambient temperature

With Nitrogen dioxide;

DOI:10.1002/prac.19973390145

upstream raw materials:

anthranilic acid

dimethyl amine

2-carboxybenzene diazonium chloride

benzenedizolium-2-carboxylate

Downstream raw materials:

salicylic acid

(E)-2-((2-hydroxynaphthalen- 1-yl)diazenyl)benzoic acid

2-(dimethylcarbamoyl-phenyldisulfanyl)-M,N-dimethylbenzamide

C₁₁H₁₄N₄O₃

Refernces

• 1、 Okuma, Kentaro,Nojima, Akiko,Nakamura, Yuki,Matsunaga, Nahoko,Nagahora, Noriyoshi,Shioji, Kosei. "Reaction of benzyne with formamides and acetylimidazole". experimental part. p. 328 - 332. Retrieved 2011/05/14.
• 2、 Kaupp, Gerd,Schmeyers, Jens,Haak, Michael,Marquardt, Thorsten,Herrmann, Andreas. "AFM in organic solid state reactions". . p. 315 - 317. Retrieved 2007/10/03.