CAS 1401464-08-1: (1α,5α,6α)-3-[(1,1-Dimethylethoxy)carbonyl]-3-azabicyclo[3.1.0]hexane-6-acetic acid

Description: The chemical substance known as "(1α,5α,6α)-3-[(1,1-Dimethylethoxy)carbonyl]-3-azabicyclo[3.1.0]hexane-6-acetic acid" with CAS number 1401464-08-1 is a bicyclic compound characterized by its unique azabicyclo structure, which incorporates a nitrogen atom within a bicyclic framework. This compound features a dimethylethoxycarbonyl group, contributing to its reactivity and potential applications in organic synthesis. The presence of the acetic acid moiety suggests that it may exhibit acidic properties, which could influence its solubility and interaction with biological systems. The stereochemistry indicated by the 1α, 5α, and 6α designations implies specific spatial arrangements of substituents, which can significantly affect the compound's pharmacological activity and binding affinity in biological contexts. Overall, this compound may be of interest in medicinal chemistry and drug development due to its structural complexity and potential biological activity, although specific biological data would be necessary to fully understand its implications.

Formula: C₁₂H₁₉NO₄

InChI: InChI=1/C12H19NO4/c1-12(2,3)17-11(16)13-5-8-7(4-10(14)15)9(8)6-13/h7-9H,4-6H2,1-3H3,(H,14,15)/t7-,8-,9+

InChI key: InChIKey=ZABCRTNBUJAXAL-PSVAKVPMNA-N

SMILES: O=C(OC(C)(C)C)N1CC2C(CC(=O)O)C2C1

Synonyms:

• 3-Azabicyclo[3.1.0]hexane-6-acetic acid, 3-[(1,1-dimethylethoxy)carbonyl]-, (1α,5α,6α)-
• (1α,5α,6α)-3-[(1,1-Dimethylethoxy)carbonyl]-3-azabicyclo[3.1.0]hexane-6-acetic acid

2-((1R,5S,6S)-3-(TERT-BUTOXYCARBONYL)-3-AZABICYCLO[3.1.0]HEXAN-6-YL)ACETIC ACID

CAS: 1401464-08-1

• Formula: C₁₂H₁₉NO₄
• Purity: 97%
• Color and Shape: Solid
• Molecular weight: 241.2836

2-((1R,5S,6s)-3-(tert-Butoxycarbonyl)-3-azabicyclo[3.1.0]hexan-6-yl)acetic acid

CAS: 1401464-08-1

Versatile small molecule scaffold

• Formula: C₁₂H₁₉NO₄
• Purity: Min. 95%
• Molecular weight: 241.28 g/mol

2-((1R,5S,6S)-3-(TERT-BUTOXYCARBONYL)-3-AZABICYCLO[3.1.0]HEXAN-6-YL)ACETIC ACID

CAS: 1401464-08-1

• Purity: 95%
• Color and Shape: Liquid
• Molecular weight: 241.287