tert-Butyl 3-(4-carbamoylbenzene-1-sulfonyl)azetidine-1-carboxylate

Base Information

• Chemical Name: tert-Butyl 3-(4-carbamoylbenzene-1-sulfonyl)azetidine-1-carboxylate
• CAS No.: 887587-05-5
• Molecular Formula: C15H20 N2 O5 S
• Molecular Weight: 340.39
• DSSTox Substance ID: DTXSID40698804
• Wikidata: Q82629281
• Mol file: 887587-05-5.mol

Synonyms:887587-05-5;tert-Butyl 3-(4-carbamoylbenzene-1-sulfonyl)azetidine-1-carboxylate;DTXSID40698804;tert-Butyl 3-((4-carbamoylphenyl)sulfonyl)azetidine-1-carboxylate;TERT-BUTYL 3-(4-CARBAMOYLBENZENESULFONYL)AZETIDINE-1-CARBOXYLATE

Chemical Property of tert-Butyl 3-(4-carbamoylbenzene-1-sulfonyl)azetidine-1-carboxylate

Chemical Property:

• PSA: 115.15000
• LogP: 2.89750
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 340.10929292
• Heavy Atom Count: 23
• Complexity: 562

Purity/Quality:

99%min ^*data from raw suppliers

3-(4-carbamoyl-benzenesulfonyl)-azetidine-1-carboxylicacidtert-butylester 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CC(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N