3-(2-nitrophenyl)-2-[(E)-(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one

Base Information

• Chemical Name: 3-(2-nitrophenyl)-2-[(E)-(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
• CAS No.: 6150-74-9
• Molecular Formula: C13H10 O6 . H2 O
• Molecular Weight: 452.4614
• DSSTox Substance ID: DTXSID90417522
• Wikidata: Q82227504

Synonyms:6150-74-9;AC1NT88N;HMS603F22;DTXSID90417522;CCG-14396;AKOS001630382;BIM-0021750.P001;SR-01000453840;SR-01000453840-1;Benzophenone, 2,3',4,4',6-pentahydroxy-, monohydrate;Methanone, (3,4-dihydroxyphenyl)(2,4,6-trihydroxyphenyl)-, monohydrate;3-(2-nitrophenyl)-2-[(E)-(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one

Chemical Property of 3-(2-nitrophenyl)-2-[(E)-(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one

Chemical Property:

• Vapor Pressure: 9.99E-16mmHg at 25°C
• Boiling Point: 628.9°Cat760mmHg
• Flash Point: 334.1°C
• Density: 1.35g/cm³
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 452.14845513
• Heavy Atom Count: 34
• Complexity: 894

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN1C2=CC=CC=C2C(=CC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5[N+](=O)[O-])C1=O
• Isomeric SMILES: CCCN1C2=CC=CC=C2/C(=C\C3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5[N+](=O)[O-])/C1=O

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