Terbequinil

Base Information

• Chemical Name: Terbequinil
• CAS No.: 113079-82-6
• Molecular Formula: C15H18 N2 O3
• Molecular Weight: 274.32
• UNII: 0DH9WUS03O
• DSSTox Substance ID: DTXSID50150281
• Nikkaji Number: J561.876B
• Wikipedia: Terbequinil
• Wikidata: Q7701656
• NCI Thesaurus Code: C73243
• ChEMBL ID: CHEMBL2105466
• Mol file: 113079-82-6.mol

Synonyms:Terbequinil;113079-82-6;Terbequinil [INN];Terbequinilo;Terbequinilum;Terbequinilum [INN-Latin];Terbequinilo [INN-Spanish];1-(methoxymethyl)-4-oxo-N-propylquinoline-3-carboxamide;UNII-0DH9WUS03O;0DH9WUS03O;SR 25776;1-Methoxymethyl-4-oxo-1,4-dihydroquinoline 3-(N-propyl)carboxamide;1,4-Dihydro-1-(methoxymethyl)-4-oxo-N-propyl-3-quinolinecarboxamide;3-Quinolinecarboxamide, 1,4-dihydro-1-(methoxymethyl)-4-oxo-N-propyl-;SCHEMBL195149;CHEMBL2105466;DTXSID50150281;LS-141431;Q7701656;1-(methoxymethyl)-4-oxo-N-propyl-1,4-dihydroquinoline-3-carboxamide

Chemical Property of Terbequinil

Chemical Property:

• Vapor Pressure: 3.56E-08mmHg at 25°C
• Melting Point: 159 °C
• Boiling Point: 446.7°C at 760 mmHg
• PKA: 12.85±0.20(Predicted)
• Flash Point: 224°C
• PSA: 63.82000
• Density: 1.181g/cm³
• LogP: 2.32000
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 274.13174244
• Heavy Atom Count: 20
• Complexity: 406

Purity/Quality:

96% ^*data from raw suppliers

TERBEQUINIL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCNC(=O)C1=CN(C2=CC=CC=C2C1=O)COC