1-(5-Bromo-2-methoxyphenylsulfonyl)pyrrolidine

Base Information

• Chemical Name: 1-(5-Bromo-2-methoxyphenylsulfonyl)pyrrolidine
• CAS No.: 691381-10-9
• Molecular Formula: C11H14 Br N O3 S
• Molecular Weight: 320.2
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID10351439
• Wikidata: Q82127854
• ChEMBL ID: CHEMBL1572936
• Mol file: 691381-10-9.mol

Synonyms:691381-10-9;1-((5-bromo-2-methoxyphenyl)sulfonyl)pyrrolidine;1-(5-BROMO-2-METHOXYPHENYLSULFONYL)PYRROLIDINE;1-(5-bromo-2-methoxyphenyl)sulfonylpyrrolidine;4-Bromo-2-(pyrrolidin-1-ylsulphonyl)anisole;4-bromo-2-(1-pyrrolidinylsulfonyl)phenyl methyl ether;MLS000547927;Pyrrolidine,1-[(5-bromo-2-methoxyphenyl)sulfonyl]-;CHEMBL1572936;DTXSID10351439;HMS2340M23;MFCD04091911;AKOS001272978;AM87144;BS-22637;SMR000113708;CS-0211429;F73053;A866901;AP-263/42173424;1-(5-Bromo-2-methoxybenzene-1-sulfonyl)pyrrolidine;Z45509103;1-(5-BROMO-2-METHOXYBENZENESULPHONYL)PYRROLIDINE

Chemical Property of 1-(5-Bromo-2-methoxyphenylsulfonyl)pyrrolidine

Chemical Property:

• Vapor Pressure: 7.75E-08mmHg at 25°C
• Melting Point: 116-120
• Boiling Point: 437°C at 760 mmHg
• PKA: -5.32±0.20(Predicted)
• Flash Point: 218.1°C
• PSA: 54.99000
• Density: 1.545g/cm³
• LogP: 3.26090
• Storage Temp.: Keep Cold
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 318.98778
• Heavy Atom Count: 17
• Complexity: 348

Purity/Quality:

95-99% ^*data from raw suppliers

1-(5-Bromo-2-methoxyphenylsulfonyl)pyrrolidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCC2