2H-1-Benzopyran-2-one, 8-(2-methoxyethoxy)-3-(1H-tetrazol-5-yl)-

Base Information

• Chemical Name: 2H-1-Benzopyran-2-one, 8-(2-methoxyethoxy)-3-(1H-tetrazol-5-yl)-
• CAS No.: 80916-80-9
• Molecular Formula: C13H12N4O4
• Molecular Weight: 288.2588
• DSSTox Substance ID: DTXSID00230784
• Wikidata: Q83111499
• Mol file: 80916-80-9.mol

Synonyms:80916-80-9;8-(3-Oxabutoxy)-3-(1H-tetrazol-5-yl)coumarin;2H-1-Benzopyran-2-one, 8-(2-methoxyethoxy)-3-(1H-tetrazol-5-yl)-;8-(2-Methoxyethoxy)-3-(1H-tetrazol-5-yl)-2H-1-benzopyran-2-one;SCHEMBL11018980;DTXSID00230784;LS-39738;8-(2-Methoxyethoxy)-3-(2H-tetrazol-5-yl)-2H-chromen-2-one

Chemical Property of 2H-1-Benzopyran-2-one, 8-(2-methoxyethoxy)-3-(1H-tetrazol-5-yl)-

Chemical Property:

• Vapor Pressure: 5.44E-13mmHg at 25°C
• Boiling Point: 569.7°Cat760mmHg
• Flash Point: 298.3°C
• PSA: 103.13000
• Density: 1.436g/cm³
• LogP: 0.99830
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 288.08585488
• Heavy Atom Count: 21
• Complexity: 417

Purity/Quality:

2H-1-BENZOPYRAN-2-ONE, 8-(2-METHOXYETHOXY)-3-(1H-TETRAZOL-5-YL)- 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COCCOC1=CC=CC2=C1OC(=O)C(=C2)C3=NNN=N3