Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dimethyl ester, (2-alpha,3-beta,4-alpha,6-alpha)-

Base Information

• Chemical Name: Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dimethyl ester, (2-alpha,3-beta,4-alpha,6-alpha)-
• CAS No.: 72973-00-3
• Molecular Formula: C22H26NO4PS
• Molecular Weight: 431.4849
• DSSTox Substance ID: DTXSID70223244
• Wikidata: Q76155413

Synonyms:72973-00-3;Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dimethyl ester, (2-alpha,3-beta,4-alpha,6-alpha)-;C22-H26-N-O4-P-S;C22H26NO4PS;DTXSID70223244;LS-108930

Chemical Property of Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dimethyl ester, (2-alpha,3-beta,4-alpha,6-alpha)-

Chemical Property:

• Vapor Pressure: 1.21E-13mmHg at 25°C
• Boiling Point: 565.9°Cat760mmHg
• Flash Point: 296°C
• Density: 1.28g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 431.13201648
• Heavy Atom Count: 29
• Complexity: 642

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(NC(CC1(C#CSP(=O)(OC)OC)O)C2=CC=CC=C2)C3=CC=CC=C3
• Isomeric SMILES: C[C@@H]1[C@H](N[C@H](C[C@]1(C#CSP(=O)(OC)OC)O)C2=CC=CC=C2)C3=CC=CC=C3

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