Description

tert-Butyl (3-phenoxypropyl)carbamate (CAS No. 1479496-35-9) is a high-purity organic compound with the molecular formula C₁₄H₂₁NO₃ and an IUPAC name of tert-butyl N-(3-phenoxypropyl)carbamate. This specialized carbamate derivative features a tert-butoxycarbonyl (Boc) protecting group, making it a valuable intermediate in peptide synthesis and medicinal chemistry applications. The compound’s unique structure, combining a phenoxypropyl moiety with a Boc-protected amine, offers versatile reactivity for further functionalization.

Our product is synthesized under strict quality control measures to ensure ≥95% purity (HPLC) and is supplied as a white to off-white crystalline solid. Each batch undergoes rigorous analytical characterization including ¹H NMR, ¹³C NMR, and mass spectrometry for identity confirmation. The material is packaged under inert atmosphere to ensure stability and is available in research quantities from 100mg to 10g scale.

Key applications include use as: a building block in pharmaceutical development, a precursor for novel polymer materials, and a reagent in organic synthesis. The Boc protecting group can be readily removed under mild acidic conditions, making this compound particularly useful for multi-step synthetic sequences.

Properties

• CAS Number: 1479496-35-9
• Complexity: 242
• IUPAC Name: tert-butyl N-(3-phenoxypropyl)carbamate
• InChI: InChI=1S/C14H21NO3/c1-14(2,3)18-13(16)15-10-7-11-17-12-8-5-4-6-9-12/h4-6,8-9H,7,10-11H2,1-3H3,(H,15,16)
• InChI Key: JPXKYTXWEVBZFI-UHFFFAOYSA-N
• Exact Mass: 251.15214353
• Molecular Formula: C14H21NO3
• Molecular Weight: 251.32
• SMILES: CC(C)(C)OC(=O)NCCCOC1=CC=CC=C1
• Topological: 47.6
• Monoisotopic Mass: 251.15214353
• Synonyms: tert-Butyl (3-phenoxypropyl)carbamate, 1479496-35-9, tert-butyl N-(3-phenoxypropyl)carbamate, MFCD21105992, SCHEMBL3160188, SCHEMBL3163463, SCHEMBL24920672, 1-(Boc-amino)-3-phenoxypropane, t-Butyl (3-phenoxypropyl)carbamate, tert-Butyl(3-phenoxypropyl)carbamate, AKOS013102155, AS-63404, CS-0047315, W16299

Application

tert-Butyl (3-phenoxypropyl)carbamate serves as a versatile intermediate in organic synthesis, particularly for the preparation of amine-containing compounds where temporary protection is required. The Boc-protected amine functionality makes this reagent valuable in peptide coupling reactions and medicinal chemistry scaffold development. Researchers utilize this compound in the synthesis of potential drug candidates, especially those targeting neurological pathways due to its phenoxypropyl structural motif. The material also finds use in materials science for creating novel polyurethane precursors with aromatic character.

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.