Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(ethylhexylamino)-3'-methyl-2'-(phenylamino)-

Base Information

• Chemical Name: Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(ethylhexylamino)-3'-methyl-2'-(phenylamino)-
• CAS No.: 70516-51-7
• Molecular Formula: C35H36N2O3
• Molecular Weight: 532.67
• DSSTox Substance ID: DTXSID90887246
• Nikkaji Number: J60.957I
• Mol file: 70516-51-7.mol

Synonyms:70516-51-7;3-(Ethylhexylamino)-6-methyl-7-anilinofluoran;Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(ethylhexylamino)-3'-methyl-2'-(phenylamino)-;Spiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one, 6'-(ethylhexylamino)-3'-methyl-2'-(phenylamino)-;DTXSID90887246;2'-Anilino-6'-(N-ethyl-N-hexylamino)-3'-methylspiro[phthalide-3,9'-[9H]xanthene]

Chemical Property of Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(ethylhexylamino)-3'-methyl-2'-(phenylamino)-

Chemical Property:

• Boiling Point: 704.5±60.0 °C(Predicted)
• PKA: 4.79±0.20(Predicted)
• Density: 1.23±0.1 g/cm3(Predicted)
• XLogP3: 8.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 532.27259301
• Heavy Atom Count: 40
• Complexity: 845

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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