Benzoic acid, 2-(2,4,5,7-tetrabromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)-, ethyl ester, sodium salt

Base Information

• Chemical Name: Benzoic acid, 2-(2,4,5,7-tetrabromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)-, ethyl ester, sodium salt
• CAS No.: 21514-87-4
• Molecular Formula: C22H12 Br4 O5 . Na
• Molecular Weight: 697.932
• Hs Code.: 32041900
• European Community (EC) Number: 244-415-7
• DSSTox Substance ID: DTXSID30944125
• Nikkaji Number: J226.246K
• Mol file: 21514-87-4.mol

Synonyms:21514-87-4;Benzoic acid, 2-(2,4,5,7-tetrabromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)-, ethyl ester, sodium salt;sodium;2,4,5,7-tetrabromo-9-(2-ethoxycarbonylphenyl)-6-oxoxanthen-3-olate;sodium 2,4,5,7-tetrabromo-9-[2-(ethoxycarbonyl)phenyl]-3-oxo-3h-xanthen-6-olate;DTXSID30944125;EINECS 244-415-7;AKOS024375400;FT-0765203;2-[2,4,5,7-Tetrabromo-3-oxo-6-(sodiooxy)-3H-xanthen-9-yl]benzoic acid ethyl ester;Sodium ethyl 2-(2,4,5,7-tetrabromo-6-oxido-3-oxo-3H-xanthen-9-yl)benzoate;2-(2,4,5,7-Tetrabromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid, ethyl ester, sodium salt;Benzoic acid, 2-(2,4,5,7-tetrabromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)-, ethyl ester, sodium salt (1:1)

Chemical Property of Benzoic acid, 2-(2,4,5,7-tetrabromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)-, ethyl ester, sodium salt

Chemical Property:

• Vapor Pressure: 4.2E-18mmHg at 25°C
• Boiling Point: 661.5°Cat760mmHg
• Flash Point: 353.8°C
• PSA: 79.57000
• Density: g/cm³
• LogP: 7.93530
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 697.71967
• Heavy Atom Count: 32
• Complexity: 886

Purity/Quality:

98% ^*data from raw suppliers

Ethyl Eosin, Certified ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 37/39-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC=CC=C1C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)Br)[O-])Br)Br)Br.[Na+]

Technology Process of Benzoic acid, 2-(2,4,5,7-tetrabromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)-, ethyl ester, sodium salt

There total 1 articles about Benzoic acid, 2-(2,4,5,7-tetrabromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)-, ethyl ester, sodium salt 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:

Eosin Y (548-26-5,602-47-1,17372-87-1) + ethyl iodide (75-03-6) → Eosin ethyl ester monosodium salt (21514-87-4)

Guidance literature:

In N,N-dimethyl-formamide; at 80 ℃;

upstream raw materials:

Eosin Y

ethyl iodide

Refernces