N-(3-Chloro-1-isopropylacetonyl)-p-toluenesulfonamide

Base Information

• Chemical Name: N-(3-Chloro-1-isopropylacetonyl)-p-toluenesulfonamide
• CAS No.: 26020-35-9
• Molecular Formula: C13H18ClNO3S
• Molecular Weight: 303.83
• DSSTox Substance ID: DTXSID00948913
• ChEMBL ID: CHEMBL315893
• Mol file: 26020-35-9.mol

Synonyms:BRN 5573823;N-Tosyl-L-valine chloromethyl ketone;N-(3-Chloro-1-isopropylacetonyl)-p-toluenesulfonamide;p-Toluenesulfonamide, N-(3-chloro-1-isopropylacetonyl)-;26020-35-9;CHEMBL315893;DTXSID00948913;LS-154115;N-(1-Chloro-4-methyl-2-oxopentan-3-yl)-4-methylbenzene-1-sulfonamide

Chemical Property of N-(3-Chloro-1-isopropylacetonyl)-p-toluenesulfonamide

Chemical Property:

• Vapor Pressure: 1.89E-07mmHg at 25°C
• Refractive Index: 1.5630 (estimate)
• Boiling Point: 425.6°Cat760mmHg
• Flash Point: 211.2°C
• PSA: 71.62000
• Density: 1.224g/cm³
• LogP: 3.57750
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 303.0695923
• Heavy Atom Count: 19
• Complexity: 395

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)CCl