1-(2-Diethylaminoethylamino)-4-methyl-thioxanthen-9-one; 4-hydroxy-2-methyl-5-propan-2-yl-benzenesulfonic acid

Base Information

• Chemical Name: 1-(2-Diethylaminoethylamino)-4-methyl-thioxanthen-9-one; 4-hydroxy-2-methyl-5-propan-2-yl-benzenesulfonic acid
• CAS No.: 16170-88-0
• Molecular Formula: C30H38N2O5S2
• Molecular Weight: 0
• NSC Number: 24953
• DSSTox Substance ID: DTXSID90282212
• Mol file: 16170-88-0.mol

Synonyms:16170-88-0;1-[2-(Diethylamino)ethylamino]-4-methylthioxanthen-9-one;4-hydroxy-2-methyl-5-propan-2-ylbenzenesulfonic acid;NSC24953;1-(2-diethylaminoethylamino)-4-methyl-thioxanthen-9-one;4-hydroxy-2-methyl-5-propan-2-yl-benzenesulfonic acid;DTXSID90282212;NSC-24953;4-Hydroxy-2-methyl-5-(propan-2-yl)benzene-1-sulfonic acid--1-{[2-(diethylamino)ethyl]amino}-4-methyl-9H-thioxanthen-9-one (1/1)

Chemical Property of 1-(2-Diethylaminoethylamino)-4-methyl-thioxanthen-9-one; 4-hydroxy-2-methyl-5-propan-2-yl-benzenesulfonic acid

Chemical Property:

• Vapor Pressure: 1.3E-10mmHg at 25°C
• Boiling Point: 512.4°Cat760mmHg
• Flash Point: 263.7°C
• PSA: 143.56000
• Density: g/cm³
• LogP: 7.70130
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 570.22221466
• Heavy Atom Count: 39
• Complexity: 730

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O.CC1=CC(=C(C=C1S(=O)(=O)O)C(C)C)O