1,4-Dioxaspiro(4.4)non-2-ylmethyl ethyl 4-(3-chlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate

Base Information

• Chemical Name: 1,4-Dioxaspiro(4.4)non-2-ylmethyl ethyl 4-(3-chlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate
• CAS No.: 155506-70-0
• Molecular Formula: C25H30 Cl N O6
• Molecular Weight: 475.9618
• UNII: 7IH970ATD2
• DSSTox Substance ID: DTXSID60935223
• Wikidata: Q27268350
• Mol file: 155506-70-0.mol

Synonyms:4-(3-chlorophenyl)-3-etoxycarbonyl-5-(1-(1,4-dioxaspiro(4,4)nonan-2-yl)methylenoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine;VULM 993;VULM-993

Chemical Property of 1,4-Dioxaspiro(4.4)non-2-ylmethyl ethyl 4-(3-chlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate

Chemical Property:

• Vapor Pressure: 5.94E-15mmHg at 25°C
• Boiling Point: 612.8°Cat760mmHg
• PKA: 2.85±0.70(Predicted)
• Flash Point: 324.4°C
• PSA: 83.09000
• Density: 1.29g/cm³
• LogP: 4.69560
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 8
• Exact Mass: 475.1761654
• Heavy Atom Count: 33
• Complexity: 831

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)Cl)C(=O)OCC3COC4(O3)CCCC4)C)C