Phenmetrazine teoclate

Base Information

• Chemical Name: Phenmetrazine teoclate
• CAS No.: 13931-75-4
• Molecular Formula: C18H22ClN5O3
• Molecular Weight: 177.2429
• European Community (EC) Number: 237-701-8
• DSSTox Substance ID: DTXSID60930435
• Wikidata: Q27276355
• Mol file: 13931-75-4.mol

Synonyms:Phenmetrazine teoclate;Phenmetrazine theoclate;13931-75-4;Phenmetrazine 8-chlorotheophyllinate;EINECS 237-701-8;R 382;8-Chloro-7-(3-methyl-2-phenylmorpholino)theophylline;Theophylline, 8-chloro-7-(3-methyl-2-phenylmorpholino)-;Phenyl-methyl-morpholin-(dimethyl-chlor)-xanthinat [German];8-chloro-1,3-dimethyl-7H-purine-2,6-dione;3-methyl-2-phenylmorpholine;DEY0OXH13V;UNII-DEY0OXH13V;DTXSID60930435;LS-149451;Phenyl-methyl-morpholin-(dimethyl-chlor)-xanthinat;Q27276355;8-Chloro-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione--3-methyl-2-phenylmorpholine (1/1)

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Chemical Property of Phenmetrazine teoclate

Chemical Property:

• Vapor Pressure: 1.82E-08mmHg at 25°C
• Boiling Point: 285.2°Cat760mmHg
• Flash Point: 112.7°C
• PSA: 21.26000
• Density: 0.997g/cm³
• LogP: 2.06480
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 391.1411173
• Heavy Atom Count: 27
• Complexity: 452

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(OCCN1)C2=CC=CC=C2.CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl