Thiopyrano(2,3-c)pyrrole, octahydro-4,4-diphenyl-6-((2-methoxyphenyl)acetyl)-, 1-oxide, (1-alpha,4a-alpha,7a-alpha)-(+-)-

Base Information

• Chemical Name: Thiopyrano(2,3-c)pyrrole, octahydro-4,4-diphenyl-6-((2-methoxyphenyl)acetyl)-, 1-oxide, (1-alpha,4a-alpha,7a-alpha)-(+-)-
• CAS No.: 146772-47-6
• Molecular Formula: C28H29 N O3 S
• Molecular Weight: 459.5998
• DSSTox Substance ID: DTXSID20932915

Synonyms:146772-47-6;Thiopyrano(2,3-c)pyrrole, octahydro-4,4-diphenyl-6-((2-methoxyphenyl)acetyl)-, 1-oxide, (1-alpha,4a-alpha,7a-alpha)-(+-)-;C28H29NO3S;DTXSID20932915;LS-153349;6-[(2-Methoxyphenyl)acetyl]-4,4-diphenyloctahydro-1H-1lambda~4~-thiopyrano[2,3-c]pyrrol-1-one

Chemical Property of Thiopyrano(2,3-c)pyrrole, octahydro-4,4-diphenyl-6-((2-methoxyphenyl)acetyl)-, 1-oxide, (1-alpha,4a-alpha,7a-alpha)-(+-)-

Chemical Property:

• Vapor Pressure: 6.29E-19mmHg at 25°C
• Boiling Point: 690.7°Cat760mmHg
• PKA: -0.74±0.40(Predicted)
• Flash Point: 371.5°C
• PSA: 65.82000
• Density: 1.29g/cm³
• LogP: 5.00700
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 459.18681496
• Heavy Atom Count: 33
• Complexity: 681

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC=C1CC(=O)N2CC3C(C2)S(=O)CCC3(C4=CC=CC=C4)C5=CC=CC=C5

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