Tert-butyl 3-(3-bromoanilino)azetidine-1-carboxylate

Base Information

• Chemical Name: Tert-butyl 3-(3-bromoanilino)azetidine-1-carboxylate
• CAS No.: 887579-41-1
• Molecular Formula: C14H19 Br N2 O2
• Molecular Weight: 327.22
• DSSTox Substance ID: DTXSID40698768
• Wikidata: Q82629220
• Mol file: 887579-41-1.mol

Synonyms:887579-41-1;tert-butyl 3-(3-bromoanilino)azetidine-1-carboxylate;3-(3-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;TERT-BUTYL 3-[(3-BROMOPHENYL)AMINO]AZETIDINE-1-CARBOXYLATE;tert-Butyl 3-((3-bromophenyl)amino)azetidine-1-carboxylate;DTXSID40698768;AKOS012606796;EN300-4264052;Z1123699355

Chemical Property of Tert-butyl 3-(3-bromoanilino)azetidine-1-carboxylate

Chemical Property:

• PSA: 41.57000
• LogP: 3.49120
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 326.06299
• Heavy Atom Count: 19
• Complexity: 324

Purity/Quality:

99%min ^*data from raw suppliers

3-(3-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER 95.00% ^*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)NC2=CC(=CC=C2)Br