Cas no 1222709-28-5 (Benzyl trans-3-aminocyclohexylcarbamatehydrochloride)

Benzyl trans-3-aminocyclohexylcarbamate hydrochloride is a chiral cyclohexylamine derivative commonly used as an intermediate in pharmaceutical synthesis. Its trans-configuration ensures stereochemical precision, making it valuable for producing enantiomerically pure compounds. The benzyl carbamate group enhances stability while allowing selective deprotection under mild conditions. The hydrochloride salt form improves solubility in polar solvents, facilitating reactions in aqueous or protic media. This compound is particularly useful in peptidomimetics and bioactive molecule development due to its rigid cyclohexyl backbone, which can influence conformational properties. High-purity grades are available for research applications requiring stringent quality control. Proper handling under inert conditions is recommended to preserve its reactivity.
Benzyl trans-3-aminocyclohexylcarbamatehydrochloride structure
1222709-28-5 structure
Product Name:Benzyl trans-3-aminocyclohexylcarbamatehydrochloride
CAS No:1222709-28-5
MF:C14H21ClN2O2
MW:284.781742811203
CID:1067749
PubChem ID:71685848
Update Time:2025-05-22

Benzyl trans-3-aminocyclohexylcarbamatehydrochloride Chemical and Physical Properties

Names and Identifiers

    • Benzyl trans-3-aminocyclohexylcarbamate hydrochloride
    • MFCD12404929
    • 1222709-28-5
    • benzyl N-[(1R,3R)-3-aminocyclohexyl]carbamate;hydrochloride
    • Benzyl trans-3-aminocyclohexylcarbamatehydrochloride
    • trans-3-(Benzyloxycarbonylamino)cyclohexylamine hydrochloride, 97%
    • Benzyltrans-3-aminocyclohexylcarbamatehydrochloride
    • MDL: MFCD12404929
    • Inchi: 1S/C14H20N2O2.ClH/c15-12-7-4-8-13(9-12)16-14(17)18-10-11-5-2-1-3-6-11;/h1-3,5-6,12-13H,4,7-10,15H2,(H,16,17);1H/t12-,13-;/m1./s1
    • InChI Key: SBODKRLYZILWEM-OJERSXHUSA-N
    • SMILES: Cl.O(CC1C=CC=CC=1)C(N[C@@H]1CCC[C@H](C1)N)=O

Computed Properties

  • Exact Mass: 284.1291556g/mol
  • Monoisotopic Mass: 284.1291556g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 5
  • Complexity: 265
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 64.4?2

Benzyl trans-3-aminocyclohexylcarbamatehydrochloride Pricemore >>

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Additional information on Benzyl trans-3-aminocyclohexylcarbamatehydrochloride

Comprehensive Overview of Benzyl trans-3-aminocyclohexylcarbamate hydrochloride (CAS No. 1222709-28-5)

Benzyl trans-3-aminocyclohexylcarbamate hydrochloride (CAS No. 1222709-28-5) is a specialized organic compound that has garnered significant attention in pharmaceutical and biochemical research. This compound, characterized by its unique cyclohexylcarbamate structure, is often explored for its potential applications in drug development and therapeutic interventions. The trans-3-aminocyclohexyl moiety is particularly noteworthy, as it contributes to the compound's stereochemical properties, which are critical for binding affinity and biological activity.

In recent years, the demand for Benzyl trans-3-aminocyclohexylcarbamate hydrochloride has surged due to its relevance in targeting specific enzymes and receptors. Researchers are increasingly focusing on its role in modulating neurological pathways, making it a subject of interest for conditions such as chronic pain and neurodegenerative disorders. The compound's hydrochloride salt form enhances its solubility, facilitating easier formulation in preclinical studies.

One of the most frequently searched questions about CAS No. 1222709-28-5 revolves around its synthetic routes and purity standards. Laboratories prioritize high-purity grades of this compound to ensure reproducible results in assays. Additionally, the benzyl carbamate group is often discussed in forums dedicated to medicinal chemistry, where experts debate its metabolic stability and pharmacokinetic profile.

The versatility of Benzyl trans-3-aminocyclohexylcarbamate hydrochloride extends to its use in peptide mimetics and prodrug design. Its aminocyclohexyl backbone is a common scaffold in bioactive molecules, which aligns with the growing trend of structure-activity relationship (SAR) studies. This has led to a spike in searches for "SAR of cyclohexylcarbamate derivatives" and "optimization of trans-3-aminocyclohexyl compounds."

From an industrial perspective, the compound's stability under various pH conditions is a hot topic. Manufacturers and researchers alike seek data on its degradation profiles, especially when considering long-term storage or formulation in aqueous solutions. The hydrochloride counterion is often highlighted for its role in improving shelf life and compatibility with excipients.

Another area of interest is the environmental impact of synthesizing Benzyl trans-3-aminocyclohexylcarbamate hydrochloride. With sustainability becoming a global priority, green chemistry approaches are being explored to minimize waste and energy consumption during production. Searches for "eco-friendly synthesis of CAS No. 1222709-28-5" reflect this shift in focus.

In summary, Benzyl trans-3-aminocyclohexylcarbamate hydrochloride (CAS No. 1222709-28-5) is a compound of immense scientific and industrial value. Its structural features, such as the trans-3-aminocyclohexyl and benzyl carbamate groups, make it a versatile candidate for diverse applications. As research progresses, this compound is likely to remain at the forefront of discussions in medicinal chemistry and drug discovery.

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