2-(1-Ethoxycarbonyl-1-propyl)-3-oxo-5,6-di(paramethoxyphenyl)-as-triazine

Base Information

• Chemical Name: 2-(1-Ethoxycarbonyl-1-propyl)-3-oxo-5,6-di(paramethoxyphenyl)-as-triazine
• CAS No.: 108734-83-4
• Molecular Formula: C23H25 N3 O5
• Molecular Weight: 423.46
• DSSTox Substance ID: DTXSID70910844
• Mol file: 108734-83-4.mol

Synonyms:108734-83-4;2-(1-Ethoxycarbonyl-1-propyl)-3-oxo-5,6-di(paramethoxyphenyl)-as-triazine;Ethyl 5,6-bis(4-methoxyphenyl)-alpha-ethyl-3-oxo-1,2,4-triazine-2(3H)-acetate;ethyl 2-[5,6-bis(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2-yl]butanoate;1,2,4-Triazine-2(3H)-acetic acid, 5,6-bis(4-methoxyphenyl)-alpha-ethyl-3-oxo-, ethyl ester;1,2,4-Triazine-2(3H)-acetic acid, 5,6-bis(4-methoxyphenyl)-alpha-ethyl -3-oxo-, ethyl ester;DTXSID70910844;FGZCPFGUIQVTMU-UHFFFAOYSA-N;LS-155001;Ethyl 2-[5,6-bis(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]butanoate

Chemical Property of 2-(1-Ethoxycarbonyl-1-propyl)-3-oxo-5,6-di(paramethoxyphenyl)-as-triazine

Chemical Property:

• Vapor Pressure: 8.1E-12mmHg at 25°C
• Boiling Point: 542.2°Cat760mmHg
• PKA: -1.22±0.20(Predicted)
• Flash Point: 281.7°C
• PSA: 92.54000
• Density: 1.21g/cm³
• LogP: 3.50370
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 423.17942091
• Heavy Atom Count: 31
• Complexity: 691

Purity/Quality:

1,2,4-TRIAZINE-2(3H)-ACETIC ACID, 5,6-BIS(4-METHOXYPHENYL)-ALPHA-ETHYL-3-OXO-, ETHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C(=O)OCC)N1C(=O)N=C(C(=N1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC