Bucillamine CAS NO.65002-17-7

 Bucillamine (65002-17-7) also can be called Thiobutarit ;  N-(2-Mercapto-2-methylpropionyl)-L-cysteine ;  N-(2-Mercapto-2-methyl-1-oxopropyl)-L-cysteine ;  N-(2-Mercaptoisobutyryl)-L-cysteine ; L-Cysteine,  N-(2-mercapto-2-methyl-1-oxopropyl)- .

Molecular Formula: C₇H₁₃NO₃S₂
                    Molar mass: 223.31 g/mol
                    EINECS: 226-710-2
                    Density: 1.289 g/cm³ 
                    Flash Point: 218.7 °C 
                    Index of Refraction: 1.552 
                    Boiling Point: 438 °C at 760 mmHg 
                    Vapour Pressure: 6.77E-09 mmHg at 25°C 
                    Appearance: White crystal or crystalline powder, slightly foul
                    Solubility: Soluble in methanol, ethanol or acetic acid, soluble  in chloroform, ethyl ether or ethyl acetate, very slightly soluble in  water
                    Product categories of Bucillamine (65002-17-7): Non-steroidal Anti-inflammatory Drugs;Central Nervous System Drugs.
                    Structure of Bucillamine (65002-17-7):
                                       
                    XLogP3-AA: 0.4
                    H-Bond Donor: 2
                    H-Bond Acceptor: 3
                    IUPAC Name: 2-[(2-Methyl-2-sulfanylpropanoyl)amino]-3-sulfanylpropanoic acid
                    Canonical SMILES: CC(C)(C(=O)NC(CS)C(=O)O)S
                    InChI: InChI=1S/C7H13NO3S2/c1-7(2,13)6(11)8-4(3-12)5(9)10/h4,12-13H,3H2,1-2H3,(H,8,11)(H,9,10)  
                    InChIKey: VUAFHZCUKUDDBC-UHFFFAOYSA-N