2-(2-Anilinovinyl)-5,6-dimethyl-3-ethylbenzoxazolium iodide

Base Information

• Chemical Name: 2-(2-Anilinovinyl)-5,6-dimethyl-3-ethylbenzoxazolium iodide
• CAS No.: 67990-11-8
• Molecular Formula: C19H21IN2O
• Molecular Weight: 420.28731
• European Community (EC) Number: 268-035-6
• Mol file: 67990-11-8.mol

Synonyms:EINECS 268-035-6;2-(2-Anilinovinyl)-5,6-dimethyl-3-ethylbenzoxazolium iodide;C19H21N2O.I;C19-H21-N2-O.I;Benzoxazolium, 3-ethyl-5,6-dimethyl-2-(2-(phenylamino)ethenyl)-, iodide;Benzoxazolium, 3-ethyl-5,6-dimethyl-2-(2-(phenylamino)ethenyl)-, iodide (1:1);67990-11-8;3-Ethyl-5,6-dimethyl-2-(2-(phenylamino)vinyl)benzoxazolium iodide;3-ethyl-5,6-dimethyl-2-[2-(phenylamino)vinyl]benzoxazolium iodide;Benzoxazolium, 3-ethyl-5,6-dimethyl-2-[2-(phenylamino)ethenyl]-, iodide

Chemical Property of 2-(2-Anilinovinyl)-5,6-dimethyl-3-ethylbenzoxazolium iodide

Chemical Property:

• PSA: 30.43000
• LogP: 5.33330
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 420.06986
• Heavy Atom Count: 23
• Complexity: 378

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC[N+]1=C(OC2=C1C=C(C(=C2)C)C)C=CNC3=CC=CC=C3.[I-]
• Isomeric SMILES: CC[N+]1=C(OC2=C1C=C(C(=C2)C)C)/C=C\NC3=CC=CC=C3.[I-]

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