Teasuprine

Base Information

• Chemical Name: Teasuprine
• CAS No.: 60640-79-1
• Molecular Formula: C27H33N5O7
• Molecular Weight: 539.5802
• DSSTox Substance ID: DTXSID20976076

Synonyms:Teasuprine;TI-72;4-Hydroxy-N-(1-methyl-2-phenoxyethyl)norephedrine 7-theophyline acetate;60640-79-1;Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, 4-hydroxy-alpha-(1-(1-methyl-2-phenoxyethyl)aminoethyl)benzyl alcohol salt;DTXSID20976076;C9H10N4O4.C18H23NO3;LS-126450;C9-H10-N4-O4.C18-H23-N-O3;(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetic acid--4-{1-hydroxy-2-[(1-phenoxypropan-2-yl)amino]propyl}phenol (1/1)

Chemical Property of Teasuprine

Chemical Property:

• Vapor Pressure: 3.45E-10mmHg at 25°C
• Boiling Point: 484.2°C at 760 mmHg
• Flash Point: 246.6°C
• PSA: 160.84000
• LogP: 1.78040
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 9
• Exact Mass: 539.23799841
• Heavy Atom Count: 39
• Complexity: 684

Purity/Quality:

TEASUPRINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(COC1=CC=CC=C1)NC(C)C(C2=CC=C(C=C2)O)O.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O

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