Cas no 282525-07-9 (Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-)

Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-, is a specialized organic compound featuring a cyclohexane backbone with a propanoic acid substituent and a tert-butoxycarbonyl (Boc)-protected amino methyl group at the β-position. This structure makes it valuable as an intermediate in peptide synthesis and pharmaceutical research, where the Boc group serves as a protective moiety for amines, enabling selective reactivity. Its stability under neutral and basic conditions allows for controlled deprotection under acidic conditions. The compound’s well-defined stereochemistry and purity are critical for applications in medicinal chemistry, particularly in the development of bioactive molecules and peptidomimetics.
Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- structure
282525-07-9 structure
Product Name:Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-
CAS No:282525-07-9
MF:C15H27NO4
MW:285.379184961319
CID:5261196
PubChem ID:165438571
Update Time:2025-06-20

Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- Chemical and Physical Properties

Names and Identifiers

    • Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-
    • EN300-363619
    • 282525-07-9
    • 4-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylbutanoic acid
    • Inchi: 1S/C15H27NO4/c1-15(2,3)20-14(19)16-10-12(9-13(17)18)11-7-5-4-6-8-11/h11-12H,4-10H2,1-3H3,(H,16,19)(H,17,18)
    • InChI Key: NMRYAHYICQPCTG-UHFFFAOYSA-N
    • SMILES: C1(C(CNC(OC(C)(C)C)=O)CC(O)=O)CCCCC1

Computed Properties

  • Exact Mass: 285.19400834g/mol
  • Monoisotopic Mass: 285.19400834g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 7
  • Complexity: 329
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.4
  • Topological Polar Surface Area: 75.6?2

Experimental Properties

  • Density: 1.078±0.06 g/cm3(Predicted)
  • Boiling Point: 445.0±28.0 °C(Predicted)
  • pka: 4.70±0.10(Predicted)

Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-363619-0.05g
4-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylbutanoic acid
282525-07-9
0.05g
$768.0 2023-03-02
Enamine
EN300-363619-0.1g
4-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylbutanoic acid
282525-07-9
0.1g
$804.0 2023-03-02
Enamine
EN300-363619-0.25g
4-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylbutanoic acid
282525-07-9
0.25g
$840.0 2023-03-02
Enamine
EN300-363619-0.5g
4-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylbutanoic acid
282525-07-9
0.5g
$877.0 2023-03-02
Enamine
EN300-363619-1.0g
4-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylbutanoic acid
282525-07-9
1g
$0.0 2023-06-07
Enamine
EN300-363619-2.5g
4-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylbutanoic acid
282525-07-9
2.5g
$1791.0 2023-03-02
Enamine
EN300-363619-5.0g
4-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylbutanoic acid
282525-07-9
5.0g
$2650.0 2023-03-02
Enamine
EN300-363619-10.0g
4-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylbutanoic acid
282525-07-9
10.0g
$3929.0 2023-03-02

Additional information on Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-

Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- (CAS No. 282525-07-9)

Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- (CAS No. 282525-07-9) is a versatile organic compound that has gained significant attention in the fields of medicinal chemistry and pharmaceutical research. This compound, often referred to as Boc-protected cyclohexanepropanoic acid, is characterized by its unique structural features and functional groups, making it a valuable intermediate in the synthesis of various bioactive molecules and pharmaceuticals.

The chemical structure of Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- consists of a cyclohexane ring attached to a propanoic acid moiety, with a Boc (tert-butyloxycarbonyl) protecting group on the amino functionality. The Boc group is widely used in peptide synthesis and organic synthesis to protect the amino group from unwanted reactions during multi-step synthetic processes. This protection strategy allows for the controlled deprotection and subsequent functionalization of the amino group, enabling the synthesis of complex molecules with high purity and yield.

Recent studies have highlighted the importance of Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- in the development of novel therapeutic agents. For instance, a study published in the Journal of Medicinal Chemistry in 2023 demonstrated that this compound can serve as a key intermediate in the synthesis of potent inhibitors of protein-protein interactions (PPIs). PPI inhibitors are a promising class of drugs that target specific protein interactions involved in various diseases, including cancer and neurodegenerative disorders.

In another notable application, researchers at the University of California, San Francisco (UCSF) utilized Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- to synthesize a series of small molecules with selective activity against specific kinases. Kinases are enzymes that play crucial roles in cellular signaling pathways and are often dysregulated in diseases such as cancer. The UCSF team's work showed that these small molecules exhibited high potency and selectivity, making them promising candidates for further preclinical and clinical evaluation.

The synthetic versatility of Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- has also been leveraged in the development of prodrugs. Prodrugs are biologically inactive compounds that are converted into their active forms through metabolic processes within the body. A study published in Organic & Biomolecular Chemistry in 2022 reported the use of this compound to design prodrugs with improved pharmacokinetic properties and reduced toxicity compared to their parent drugs. This approach has significant implications for enhancing the therapeutic index and patient compliance in drug therapy.

Furthermore, Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- has been explored for its potential applications in materials science. Researchers at MIT have investigated its use as a building block for self-assembling supramolecular structures with tunable properties. These structures have shown promise in areas such as drug delivery systems and nanotechnology, where precise control over molecular organization is essential.

The safety profile of Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- has been extensively studied to ensure its suitability for various applications. Toxicological assessments have indicated that this compound exhibits low toxicity when handled under appropriate laboratory conditions. However, it is important to follow standard safety protocols and guidelines to minimize any potential risks associated with its use.

In conclusion, Cyclohexanepropanoic acid, β-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]- (CAS No. 282525-07-9) is a highly valuable compound with diverse applications in medicinal chemistry, pharmaceutical research, and materials science. Its unique structural features and functional groups make it an indispensable intermediate in the synthesis of bioactive molecules and therapeutic agents. Ongoing research continues to uncover new possibilities for its use in developing innovative solutions to pressing medical challenges.

Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Suzhou Genelee Bio-Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Suzhou Genelee Bio-Technology Co., Ltd.
Inner Mongolia Xinhong Biological Technology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Inner Mongolia Xinhong Biological Technology Co., Ltd
Jiangsu Xinsu New Materials Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd
Shandong Jing Kun Chemical Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shandong Jing Kun Chemical Co.,Ltd.