10-Acetyl-phenoxazine-3,7-diol diacetate

Base Information

• Chemical Name: 10-Acetyl-phenoxazine-3,7-diol diacetate
• CAS No.: 93729-77-2
• Molecular Formula: C₁₈H₁₅NO₆
• Molecular Weight: 341.32
• DSSTox Substance ID: DTXSID00556754
• Wikidata: Q82438437
• Mol file: 93729-77-2.mol

Synonyms:93729-77-2;10-ACETYL-PHENOXAZINE-3,7-DIOL DIACETATE;(10-acetyl-7-acetyloxyphenoxazin-3-yl) acetate;SCHEMBL10038462;DTXSID00556754;Ethanone,1-[3,7-bis(acetyloxy)-10H-phenoxazin-10-yl]-;10-Acetyl-10H-phenoxazine-3,7-diyl diacetate

Chemical Property of 10-Acetyl-phenoxazine-3,7-diol diacetate

Chemical Property:

• Vapor Pressure: 5.88E-14mmHg at 25°C
• Boiling Point: 591.3oC at 760 mmHg
• Flash Point: 311.4oC
• PSA: 82.14000
• Density: 1.34g/cm3
• LogP: 3.39250
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 341.08993720
• Heavy Atom Count: 25
• Complexity: 510

Purity/Quality:

98%Min ^*data from raw suppliers

10-ACETYL-PHENOXAZINE-3,7-DIOL DIACETATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)N1C2=C(C=C(C=C2)OC(=O)C)OC3=C1C=CC(=C3)OC(=O)C

Technology Process of 10-Acetyl-phenoxazine-3,7-diol diacetate

There total 3 articles about 10-Acetyl-phenoxazine-3,7-diol diacetate 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:

N,N-bis-(2,4-diacetoxy-phenyl)-acetamide (4947-02-8) → 3,7-diacetoxy-10-acetyl-10H-phenoxazine (93729-77-2)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂SO₄ / 5 h / 140 - 150 °C

2: (i) Sn, aq. HCl, (ii) /BRN= 385737/, NaOAc

With sulfuric acid;

Reference yield:

4-(4-hydroxy-anilino)-benzene-1,3-diol; hydrochloride (91569-74-3) → 3,7-diacetoxy-10-acetyl-10H-phenoxazine (93729-77-2)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂SO₄ / 0.17 h / 180 °C

2: (i) Sn, aq. HCl, (ii) /BRN= 385737/, NaOAc

With sulfuric acid;

Reference yield:

resorufin (635-78-9) + acetic anhydride (108-24-7) → 3,7-diacetoxy-10-acetyl-10H-phenoxazine (93729-77-2)

Guidance literature:

Multistep reaction; (i) Sn, aq. HCl, (ii) /BRN= 385737/, NaOAc;

upstream raw materials:

resorufin

acetic anhydride

N,N-bis-(2,4-diacetoxy-phenyl)-acetamide

4-(4-hydroxy-anilino)-benzene-1,3-diol; hydrochloride