2-amino-5-oxo-4-(1-phenylethyl)-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile

Base Information

• Chemical Name: 2-amino-5-oxo-4-(1-phenylethyl)-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile
• CAS No.: 5603-02-1
• Molecular Formula: C13H11NO3.ClH
• Molecular Weight: 265.696
• DSSTox Substance ID: DTXSID90386183

Synonyms:2-amino-5-oxo-4-(1-phenylethyl)-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile;5603-02-1;AE-848/11828079;TimTec1_005915;Oprea1_288061;Oprea1_720294;DTXSID90386183;DLGHPCQUNMMSHA-UHFFFAOYSA-N;HMS1550M19;STK725870;2-amino-5-oxo-4-(1-phenylethyl)-4H-pyrano[3,2-c]chromene-3-carbonitrile;AKOS000526492;SR-01000527948;SR-01000527948-1;2-amino-5-oxo-4-(1-phenylethyl)-4H,5H-pyrano[3,2-c]chromen-3-yl cyanide;2-amino-5-oxo-4-(1-phenylethyl)-4,5-dihydropyrano[3,2-c]chromene-3-carbonitrile

Chemical Property of 2-amino-5-oxo-4-(1-phenylethyl)-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile

Chemical Property:

• Vapor Pressure: 1.88E-15mmHg at 25°C
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 344.11609238
• Heavy Atom Count: 26
• Complexity: 708

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1C(=C(OC2=C1C(=O)OC3=CC=CC=C32)N)C#N)C4=CC=CC=C4

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