Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dimethyl ester, (2-alpha,3-beta,4-beta,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-beta,6-alpha)-
• CAS No.: 72973-04-7
• Molecular Formula: C22H26NO4PS
• Molecular Weight: 431.4849
• DSSTox Substance ID: DTXSID10223248
• Wikidata: Q83101680

Synonyms:72973-04-7;Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dimethyl ester, (2-alpha,3-beta,4-beta,6-alpha)-;C22-H26-N-O4-P-S;DTXSID10223248;LS-108931

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-beta,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):  
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MSDS Files:

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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