Phenothiazine-10-acetic acid

Base Information

• Chemical Name: Phenothiazine-10-acetic acid
• CAS No.: 25244-68-2
• Molecular Formula: C14H11NO2S
• Molecular Weight: 257.313
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID40363888
• Nikkaji Number: J1.118.280A
• Wikidata: Q82147639
• Mol file: 25244-68-2.mol

Synonyms:Phenothiazine-10-acetic acid;25244-68-2;2-(10H-Phenothiazin-10-yl)acetic acid;2-phenothiazin-10-ylacetic Acid;10H-phenothiazin-10-ylacetic acid;10H-Phenothiazine-10-acetic acid;Oprea1_584603;Phenothiazin-10-yl-acetic acid;SCHEMBL12311066;DTXSID40363888;MFCD03247673;STK215581;AKOS000100830;AM84838;AT24525;METHYLPERFLUORO-3,6-DIOXAHEPTANOATE;CS-0215351;EN300-236438;F2135-0375

Chemical Property of Phenothiazine-10-acetic acid

Chemical Property:

• Vapor Pressure: 1.95E-09mmHg at 25°C
• Refractive Index: 1.685
• Boiling Point: 464.7 °C at 760 mmHg
• PKA: 3.69±0.10(Predicted)
• Flash Point: 234.9 °C
• PSA: 65.84000
• Density: 1.362 g/cm³
• LogP: 3.43890
• Storage Temp.: 2-8°C
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 257.05104977
• Heavy Atom Count: 18
• Complexity: 301

Purity/Quality:

99% ^*data from raw suppliers

2-(10H-Phenothiazin-10-yl)aceticacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CC(=O)O

Technology Process of Phenothiazine-10-acetic acid

There total 8 articles about Phenothiazine-10-acetic 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: 96.0%

10H-phenothiazine (92-84-2) + potassium chloroacetate (7748-25-6) → 2-(10H-phenothiazin-10-yl)acetic acid (25244-68-2)

Guidance literature:

With triethylamine; In N,N-dimethyl-formamide; at 60 ℃; pH=8.7; Temperature; pH-value;

Reference yield: 91.0%

10H-phenothiazine (92-84-2) + ethyl bromoacetate (105-36-2) → 2-(10H-phenothiazin-10-yl)acetic acid (25244-68-2)

Guidance literature:

With potassium hydroxide; In N,N-dimethyl-formamide; for 0.0833333h; Microwave irradiation (375 W);

DOI:10.1080/00304940009355927

Reference yield: 89.0%

ethyl 2-(10H-phenothiazin-10-yl)acetate (68825-29-6) → 2-(10H-phenothiazin-10-yl)acetic acid (25244-68-2)

Guidance literature:

With potassium hydroxide; In methanol; ethanol; at 60 ℃; for 0.5h;

DOI:10.1016/j.bmcl.2006.10.094

upstream raw materials:

ethyl 2-(10H-phenothiazin-10-yl)acetate

10H-phenothiazine

bromoacetic acid

chloroacetic acid

Downstream raw materials:

N-methylphenothiazine

phenothiazino-10-acetyl chloride

11-{4-[(2-phenothiazin-10-yl-acetylamino)methyl]benzyl}-1,4,8-tri(tert-butoxycarbonyl)-1,4,8,11-tetraazacyclotetradecane

C₂₀H₁₀F₅NO₂S

Refernces

• 1、 Ito, Takeo,Kondo, Akiko,Terada, Satoru,Nishimoto, Sei-Ichi. "Photoinduced reductive repair of thymine glycol: Implications for excess electron transfer through DNA containing modified bases". . p. 10934 - 10942. Retrieved 2006.
• 2、 -. "SMALL MOLECULE INHIBITORS OF AUTOPHAGY AND HISTONE DEACTYLASES AND USES THEREOF". Page/Page column 44-45. . Retrieved 2021/05/07.
• 3、 Maddila, Suresh,Momin, Mehbub,Gorle, Sridevi,Palakondu, Lavanya,Jonnalagadda, Sreekanth B.. "Synthesis and antioxidant evaluation of novel phenothiazine linked substitutedbenzylideneamino-1,2,4-triazole derivatives". . . Retrieved 2015/11/03.