3-Ethyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide

Base Information

• Chemical Name: 3-Ethyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
• CAS No.: 16015-57-9
• Molecular Formula: C11H11 N3 O2
• Molecular Weight: 217.22
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID00368278
• Wikidata: Q82154694
• Mol file: 16015-57-9.mol

Synonyms:16015-57-9;3-Ethyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide;3-ethyl-4-oxophthalazine-1-carboxamide;3-Ethyl-4-oxo-3,4-dihydro-phthalazine-1-carboxylic acid amide;1-Phthalazinecarboxamide,3-ethyl-3,4-dihydro-4-oxo-;SCHEMBL12877226;DTXSID00368278;AKOS008002270;CS-0220123;EN300-05803;SR-01000042874;3-Ethyl-3,4-dihydro-4-oxo-1-phthalazinecarboxamide;SR-01000042874-1;Z33547006

Chemical Property of 3-Ethyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide

Chemical Property:

• Vapor Pressure: 1.01E-06mmHg at 25°C
• Boiling Point: 403.6°Cat760mmHg
• PKA: 12.07±0.20(Predicted)
• Flash Point: 197.9°C
• PSA: 77.98000
• Density: 1.36g/cm³
• LogP: 1.21560
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 217.085126602
• Heavy Atom Count: 16
• Complexity: 351

Purity/Quality:

99% ^*data from raw suppliers

3-ETHYL-4-OXO-3,4-DIHYDRO-PHTHALAZINE-1-CARBOXYLIC ACID AMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N