5-[(2S)-2-(methylamino)propyl]benzene-1,2,4-triol

Base Information

• Chemical Name: 5-[(2S)-2-(methylamino)propyl]benzene-1,2,4-triol
• CAS No.: 136706-32-6
• Molecular Formula: C10H15 N O3
• Molecular Weight: 197.23
• DSSTox Substance ID: DTXSID50897245
• Nikkaji Number: J3.087.485D
• Wikipedia: 2,4,5-Trihydroxymethamphetamine
• Wikidata: Q20706948
• Mol file: 136706-32-6.mol

Synonyms:2,4,5-trihydroxymethamphetamine;tri-HO-MA

Chemical Property of 5-[(2S)-2-(methylamino)propyl]benzene-1,2,4-triol

Chemical Property:

• Vapor Pressure: 1.32E-06mmHg at 25°C
• Boiling Point: 388.9°Cat760mmHg
• Flash Point: 175.5°C
• PSA: 0.00000
• Density: 1.234g/cm³
• LogP: 0.00000
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 197.10519334
• Heavy Atom Count: 14
• Complexity: 177

Purity/Quality:

2,4,5-TRIHYDROXYMETHAMPHETAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC(CC1=CC(=C(C=C1O)O)O)NC
• Isomeric SMILES: C[C@@H](CC1=CC(=C(C=C1O)O)O)NC

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