Spiro[1H-isoindole-1,9'-[9H]xanthen]-3(2H)-one, 3',6'-bis(diethylamino)-2-phenyl-

Base Information

• Chemical Name: Spiro[1H-isoindole-1,9'-[9H]xanthen]-3(2H)-one, 3',6'-bis(diethylamino)-2-phenyl-
• CAS No.: 38660-35-4
• Deprecated CAS: 37224-18-3,39379-49-2,39379-49-2
• Molecular Formula: C34H35 N3 O2
• Molecular Weight: 517.671
• Hs Code.: 2934999090
• European Community (EC) Number: 254-066-2
• NSC Number: 75508
• UNII: T2X9NXW5RD
• DSSTox Substance ID: DTXSID8068125
• Nikkaji Number: J319.819G
• Wikidata: Q81994837
• ChEMBL ID: CHEMBL4891119
• Mol file: 38660-35-4.mol

Synonyms:38660-35-4;3',6'-Bis(diethylamino)-2-phenylspiro[isoindoline-1,9'-xanthen]-3-one;Spiro[1H-isoindole-1,9'-[9H]xanthen]-3(2H)-one, 3',6'-bis(diethylamino)-2-phenyl-;3',6'-bis(diethylamino)-2-phenylspiro[isoindole-3,9'-xanthene]-1-one;NSC75508;T2X9NXW5RD;3',6'-bis(diethylamino)-2-phenylspiro[1h-isoindole-1,9'-[9h]xanthene]-3(2h)-one;3,6-Bis(diethylamino)fluoran-gamma-anilinolactam;3',6'-bis(diethylamino)-2-phenylspiro[isoindole-1,9'-xanthen]-3(2h)-one;EINECS 254-066-2;NSC 75508;NSC-75508;AI3-17350;Spiro(1H-isoindole-1,9'-(9H)xanthen)-3(2H)-one, 3',6'-bis(diethylamino)-2-phenyl-;3',6'-Bis(diethylamino)-2-phenylspiro(isoindole-3,9'-xanthene)-1-one;3',6'-bis(diethylamino)-2-phenyl-2,3-dihydrospiro[isoindole-1,9'-xanthen]-3-one;3',6'-Bis(diethylamino)-2-phenylspiro(1H-isoindole-1,9'-(9H)xanthene)-3(2H)-one;3',6'-BIS(DIETHYLAMINO)-2-PHENYLSPIRO(ISOINDOLE-1,9'-XANTHEN)-3(2H)-ONE;Spiro[1H-isoindole-1,9'-(9H)xanthen]-3(2H)-one, 3',6'-bis(diethylamino)-2-phenyl-;UNII-T2X9NXW5RD;CHEMBL4891119;DTXSID8068125;SCHEMBL13391164;MFCD00182788;STK747473;AKOS001720807;C34-H35-N3-O2;AS-72479;CS-0316031;A873802;3,6-Bis(Diethylamino)-2-Phenylspiro[Isoindole-3,9-Xanthene]-1-One;3',6'-bis(diethylamino)-2-phenyl-spiro[isoindoline-3,9'-xanthene]-1-one;2-Phenyl-3',6'-di(diethylamino)spiro[1H-isoindole-1,9'-[9H]xanthene]-3(2H)-one

Chemical Property of Spiro[1H-isoindole-1,9'-[9H]xanthen]-3(2H)-one, 3',6'-bis(diethylamino)-2-phenyl-

Chemical Property:

• Boiling Point: 691.5°Cat760mmHg
• Flash Point: 372°C
• PSA: 36.02000
• Density: 1.25g/cm³
• LogP: 7.50200
• Storage Temp.: 2-8°C
• XLogP3: 7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 517.27292737
• Heavy Atom Count: 39
• Complexity: 798

Purity/Quality:

97% ^*data from raw suppliers

3',6'-Bis(diethylamino)-2-phenylspiro[isoindoline-1,9'-xanthen]-3-one 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCN(CC)C1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)N(CC)CC)C5=CC=CC=C5C(=O)N3C6=CC=CC=C6

Technology Process of Spiro[1H-isoindole-1,9'-[9H]xanthen]-3(2H)-one, 3',6'-bis(diethylamino)-2-phenyl-

There total 12 articles about Spiro[1H-isoindole-1,9'-[9H]xanthen]-3(2H)-one, 3',6'-bis(diethylamino)-2-phenyl- 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: 80.0%

C26H26ClN2O2(1+) + aniline (62-53-3) → 3',6'-bis(diethylamino)-2-phenylspiro<1H-isoindole-1,9'(9H)xanthene>-3(2H)-one (38660-35-4)

Guidance literature:

In acetonitrile; for 13h; Inert atmosphere;

DOI:10.1002/anie.201510003

Reference yield: 77.0%

rhodamine B (81-88-9) + aniline (62-53-3) → 3',6'-bis(diethylamino)-2-phenylspiro<1H-isoindole-1,9'(9H)xanthene>-3(2H)-one (38660-35-4)

Guidance literature:

rhodamine B; With O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; triethylamine; In 1,2-dichloro-ethane; at 20 ℃; for 2h;

aniline; In 1,2-dichloro-ethane; at 20 ℃;

DOI:10.1002/ejoc.202100299

Reference yield: 57.0%

Rhodamine 610 perchlorate + aniline (62-53-3) → 3',6'-bis(diethylamino)-2-phenylspiro<1H-isoindole-1,9'(9H)xanthene>-3(2H)-one (38660-35-4)

Guidance literature:

Rhodamine 610 perchlorate; With p-toluenesulfonyl chloride; In dichloromethane; for 0.25h;

With dmap; In dichloromethane; at 20 ℃; for 0.25h;

aniline; In dichloromethane; for 3h;

DOI:10.1021/ja508028h

upstream raw materials:

rhodamine B

aniline

trichlorophosphate

rhodamine B