CAS No. 118414-82-7

MK-886 Pricing >

 

Product Information

Chemical Formula: C27H34ClNO2S
Molecular Weight:472.08
Synonyms:L-663,536; 1-[(4-Chlorophenyl)Methyl]-3-[(1,1-Dimethylethyl)Thio]-Alpha,Alpha-Dimethyl-5-(1-Methylethyl)-1H-Indole-2-Propanoic Acid; Mk-886; 3-[Tert-Butylthio-1-(4-Chlorobenzyl)-5-Isopropyl-1H-Indol-2-Yl]-2,2-Dimethylpropionic Acid, Sodium Salt; 3-[1-(4-Chlorobenzyl)-3-(Tert-Butylthio)-5-Isopropyl-1H-Indol-2-Yl]-2,2-Dimethylpropanoic Acid; 3-[1-(4-Chlorobenzyl)-3-(Tert-Butylthio)-5-Isopropyl-1H-Indol-2-Yl]-2,2-Dimethylpropionic Acid; 3-[3-Tert-Butylthio-1-(4-Chlorobenzyl)-5-Isopropyl-1H-Indol-2-Yl]-2,2-Dimethylpropionic Acid; Cgs-81585
MDL No.:MFCD00876710
EINECS / EC No.:N/A
Pubchem CID:3651377
IUPAC Name:3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-propan-2-ylindol-2-yl]-2,2-dimethylpropanoic acid
Standard InchI:InChI=1S/C27H34ClNO2S/c1-17(2)19-10-13-22-21(14-19)24(32-26(3,4)5)23(15-27(6,7)25(30)31)29(22)16-18-8-11-20(28)12-9-18/h8-14,17H,15-16H2,1-7H3,(H,30,31)
InchI Key:QAOAOVKBIIKRNL-UHFFFAOYSA-N
SMILES:CC(C)C1=CC2=C(C=C1)N(C(=C2SC(C)(C)C)CC(C)(C)C(=O)O)CC3=CC=C(C=C3)Cl
Appearance:white
Melting Point:N/A
Boiling Point:623.4 °C at 760 mmHg
Density (Theoretical):1.14 g/cm3
Solubility:DMSO: 32 mg/mL
Refractive Index:1.58

Safety Information

Signal Word: Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338
Flash Point:330.8 °C
Transportation Information:N/A
GHS Pictograms:Exclamation Mark - GHS07