Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(diethylamino)-2'-[(2,4-dimethylphenyl)amino]-3'-methyl-

Base Information

• Chemical Name: Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(diethylamino)-2'-[(2,4-dimethylphenyl)amino]-3'-methyl-
• CAS No.: 36431-22-8
• Deprecated CAS: 207869-51-0,87805-67-2,87805-67-2
• Molecular Formula: C33H32 N2 O3
• Molecular Weight: 504.62
• European Community (EC) Number: 609-245-3
• UNII: A369O30BOI
• DSSTox Substance ID: DTXSID0027989
• Nikkaji Number: J278.536F
• Wikidata: Q27273554
• Mol file: 36431-22-8.mol

Synonyms:36431-22-8;2-(2,4-Dimethylphenylamino)-3-methyl-6-diethylaminofluoran;3-Diethylamino-6-methyl-7-(2,4-xylidino)fluoran;UNII-A369O30BOI;6'-(diethylamino)-2'-(2,4-dimethylanilino)-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one;A369O30BOI;6'-(diethylamino)-2'-[(2,4-dimethylphenyl)amino]-3'-methyl-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one;Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(diethylamino)-2'-[(2,4-dimethylphenyl)amino]-3'-methyl-;6'-(diethylamino)-2'-((2,4-dimethylphenyl)amino)-3'-methyl-3H-spiro[isobenzofuran-1,9'-xanthen]-3-one;Spiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one, 6'-(diethylamino)-2'-((2,4-dimethylphenyl)amino)-3'-methyl-;3'-(DIETHYLAMINO)-6'-METHYL-7'-(2,4-XYLIDINO)SPIRO(ISOBENZOFURAN-1(3H),9'-(9H)XANTHEN)-3-ONE;3'-(Diethylamino)-6'-methyl-7'-(2,4-xylidino)spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one;WINCON 15;YAMAMOTO BLACK 15;SCHEMBL4609284;DTXSID0027989;2-(2',4'-Dimethylphenylamino)-3-methyl-6-diethylaminofluoran;AKOS015918412;AC-19657;AS-75531;J278.536F;LS-195492;CS-0451688;FT-0656431;E79188;A823241;Q27273554;2-(2,4-dimethylanilino)-3-methyl-6-diethylaminofluorane;3-DIETHYLAMINO-6-METHYL-7-(2',4'-DIMETHYLANILINO)FLUORAN;Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(diethylamino)-2'-[(2,4;6'-(diethylamino)-2'-(2,4-dimethylanilino)-3'-methyl-1-spiro[isobenzofuran-3,9'-xanthene]one;6'-(diethylamino)-2'-[(2,4-dimethylphenyl)amino]-3'-methyl-spiro[2-benzofuran-3,9'-xanthene]-1-one;6'-(Diethylamino)-2'-[(2,4-dimethylphenyl)amino]-3'-methylspiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one

Chemical Property of Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(diethylamino)-2'-[(2,4-dimethylphenyl)amino]-3'-methyl-

Chemical Property:

• Vapor Pressure: 1.06E-18mmHg at 25°C
• Melting Point: 170oC
• Boiling Point: 686.6°Cat760mmHg
• PKA: 4.94±0.20(Predicted)
• Flash Point: 369°C
• PSA: 50.80000
• Density: 1.27g/cm³
• LogP: 7.84260
• XLogP3: 7.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 504.24129289
• Heavy Atom Count: 38
• Complexity: 846

Purity/Quality:

99% ^*data from raw suppliers

2-(2,4-Dimethylphenylamino)-3-methyl-6-diethylaminofluoran 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=C(C(=C5)NC6=C(C=C(C=C6)C)C)C

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