Benzoxazolium, 3-ethyl-2-(2-((3-ethyl-5-phenyl-2(3H)-benzoxazolylidene)methyl)-1-butenyl)-5-phenyl-, ethyl sulfate

Base Information

• Chemical Name: Benzoxazolium, 3-ethyl-2-(2-((3-ethyl-5-phenyl-2(3H)-benzoxazolylidene)methyl)-1-butenyl)-5-phenyl-, ethyl sulfate
• CAS No.: 41503-61-1
• Molecular Formula: C37H38N2O6S
• Molecular Weight: 638.7724
• Mol file: 41503-61-1.mol

Synonyms:41503-61-1;5,5'-Diphenyl-3,3',9-triethyl-oxacarbocyanine ethylsulfate;Benzoxazolium, 3-ethyl-2-(2-((3-ethyl-5-phenyl-2(3H)-benzoxazolylidene)methyl)-1-butenyl)-5-phenyl-, ethyl sulfate;3-Ethyl-2-(2-[(3-ethyl-5-phenyl-2(3h)-benzoxazolinylidene)methyl]-1-butenyl)-5-phenylbenzoxazoliumethylsulfate;3-Ethyl-2-(3-(3-ethyl-5-phenyl-2-benzoxazolinylidene)-2-ethylpropenyl)-5-benzoxazolium, ethyl sulfate;Benzoxazolium, 3-ethyl-2-(2-((3-ethyl-5-phenyl-2(3H)-benzoxazolylidene)methyl)-1-buten-1-yl)-5-phenyl-, ethyl sulfate (1:1);Benzoxazolium, 3-ethyl-2-[2-[(3-ethyl-5-phenyl-2(3H)-benzoxazolylidene)methyl]-1-butenyl]-5-phenyl-, ethyl sulfate;C35H33N2O2.C2H5O4S;MFCD00143124;C35-H33-N2-O2.C2-H5-O4-S;3-ethyl-2-(2-[(3-ethyl-5-phenyl-2(3h)-benzoxazolinylidene)methyl]-1-butenyl)-5-phenyl benzoxazolium ethyl sulfate;3-ethyl-2-(2-[(3-ethyl-5-phenyl-2(3h)-benzoxazolinylidene)methyl]-1-butenyl)-5-phenylbenzoxazolium ethyl sulfate

Chemical Property of Benzoxazolium, 3-ethyl-2-(2-((3-ethyl-5-phenyl-2(3H)-benzoxazolylidene)methyl)-1-butenyl)-5-phenyl-, ethyl sulfate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 109.90000
• Density: g/cm³
• LogP: 8.76090
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 8
• Exact Mass: 638.24505811
• Heavy Atom Count: 46
• Complexity: 894

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

5,5'-DIPHENYL-3,3',9-TRIETHYL-OXACARBOCYANINE ETHYLSULFATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CC)C=C4N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CC.CCOS(=O)(=O)[O-]
• Isomeric SMILES: CC/C(=C\C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CC)/C=C\4/N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CC.CCOS(=O)(=O)[O-]

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