alpha-((Methyl(phenylmethyl)amino)methyl)-4-(methylsulfonyl)benzenemethanol maleate

Base Information

• Chemical Name: alpha-((Methyl(phenylmethyl)amino)methyl)-4-(methylsulfonyl)benzenemethanol maleate
• CAS No.: 56621-62-6
• Molecular Formula: C21H23NO6S
• Molecular Weight: 417.4754
• Wikidata: Q76387609
• Mol file: 56621-62-6.mol

Synonyms:alpha-((Methyl(phenylmethyl)amino)methyl)-4-(methylsulfonyl)benzenemethanol maleate;Benzenemethanol, alpha-((methyl(phenylmethyl)amino)methyl)-4-(methylsulfonyl)-, (Z)-2-butenedioate (1:1);56621-62-6;C17H21NO3S.C4H4O4;LS-30797;C17-H21-N-O3-S.C4-H4-O4

Chemical Property of alpha-((Methyl(phenylmethyl)amino)methyl)-4-(methylsulfonyl)benzenemethanol maleate

Chemical Property:

• Vapor Pressure: 1.61E-16mmHg at 25°C
• Boiling Point: 625.7°Cat760mmHg
• Flash Point: 332.2°C
• Density: 1.294g/cm³
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 10
• Exact Mass: 417.12460863
• Heavy Atom Count: 29
• Complexity: 683

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(CC1=CC=CC=C1)CC(=CC(=O)O)C(=O)OCC2=CC=C(C=C2)S(=O)(=O)C
• Isomeric SMILES: CN(CC1=CC=CC=C1)C/C(=C/C(=O)O)/C(=O)OCC2=CC=C(C=C2)S(=O)(=O)C