3-(2-(4-chlorophenylsulfanyl)phenyl)-N-(4-dimethylaminobutyl)acrylamide

Base Information

• Chemical Name: 3-(2-(4-chlorophenylsulfanyl)phenyl)-N-(4-dimethylaminobutyl)acrylamide
• CAS No.: 538368-27-3
• Molecular Formula: C21H25ClN2OS
• Molecular Weight: 425.41500
• European Community (EC) Number: 637-305-9
• UNII: 2W6T5I5964
• Nikkaji Number: J1.864.123B
• Wikidata: Q27255686
• Mol file: 538368-27-3.mol

Synonyms:3-(2-(4-chlorophenylsulfanyl)phenyl)-N-(4-dimethylaminobutyl)acrylamide;A 350619;A-350619;A350619

Chemical Property of 3-(2-(4-chlorophenylsulfanyl)phenyl)-N-(4-dimethylaminobutyl)acrylamide

Chemical Property:

• Melting Point: 175.2-176.7?°C
• PSA: 57.64000
• LogP: 6.15530
• Storage Temp.: 2-8°C
• Solubility.: H2O: 23 mg/mL
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 388.1376123
• Heavy Atom Count: 26
• Complexity: 436

Purity/Quality:

99%min ^*data from raw suppliers

3-[2-(4-CHLOROPHENYL)THIOPHENYL]-N-[4-(DIMETHYLAMINO)BUTYL]-2-PROPENAMIDE HYDROCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn,N
• Statements: 22-37/38-41-50/53
• Safety Statements: 26-36/37/39-60-61

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CN(C)CCCCNC(=O)C=CC1=CC=CC=C1SC2=CC=C(C=C2)Cl
• Isomeric SMILES: CN(C)CCCCNC(=O)/C=C/C1=CC=CC=C1SC2=CC=C(C=C2)Cl