3-(4-Fluoro-benzylamino)-azetidine-1-carboxylic acid tert-butyl ester

Base Information

• Chemical Name: 3-(4-Fluoro-benzylamino)-azetidine-1-carboxylic acid tert-butyl ester
• CAS No.: 887580-28-1
• Molecular Formula: C15H21 F N2 O2
• Molecular Weight: 280.34
• DSSTox Substance ID: DTXSID40698824
• Wikidata: Q82629319
• Mol file: 887580-28-1.mol

Synonyms:887580-28-1;3-(4-FLUORO-BENZYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;tert-butyl 3-[(4-fluorophenyl)methylamino]azetidine-1-carboxylate;1-Azetidinecarboxylicacid, 3-[[(4-fluorophenyl)methyl]amino]-, 1,1-dimethylethyl ester;tert-Butyl 3-((4-fluorobenzyl)amino)azetidine-1-carboxylate;tert-Butyl 3-{[(4-fluorophenyl)methyl]amino}azetidine-1-carboxylate;DTXSID40698824;AKOS012606925

Chemical Property of 3-(4-Fluoro-benzylamino)-azetidine-1-carboxylic acid tert-butyl ester

Chemical Property:

• PSA: 41.57000
• LogP: 2.86340
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 280.15870608
• Heavy Atom Count: 20
• Complexity: 329

Purity/Quality:

99% ^*data from raw suppliers

3-(4-Fluoro-benzylamino)-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)NCC2=CC=C(C=C2)F

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