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(1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate is a chiral chemical compound with the molecular formula C13H23NO4. It is a cyclohexanecarboxylic acid derivative featuring a methyl ester group and a tert-butoxycarbonylamino group. As a chiral molecule with two stereocenters, it exists as a pair of enantiomers. (1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate is widely recognized for its utility as a building block in organic synthesis, especially in the creation of pharmaceuticals and agrochemicals. The tert-butoxycarbonylamino group in its structure serves to protect the amine functionality, allowing for selective reactions with other functional groups. Additionally, it is employed as a starting material in the synthesis of a variety of bioactive molecules.

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  • cis-Methyl-3-((tert-butoxycarbonyl)amino)cyclohexane-1-carboxylate

    Cas No: 930596-35-3

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  • 930596-35-3 Structure
  • Basic information

    1. Product Name: (1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate
    2. Synonyms:
    3. CAS NO:930596-35-3
    4. Molecular Formula:
    5. Molecular Weight: 257.33
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 930596-35-3.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: N/A
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: (1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate(CAS DataBase Reference)
    10. NIST Chemistry Reference: (1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate(930596-35-3)
    11. EPA Substance Registry System: (1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate(930596-35-3)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 930596-35-3(Hazardous Substances Data)

930596-35-3 Usage

Uses

Used in Pharmaceutical Synthesis:
(1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate is used as a key building block for the development of pharmaceuticals. Its unique structure allows for the creation of complex molecules with potential therapeutic effects. The protecting group in its structure enables selective reactions, which is crucial for the synthesis of specific drug candidates.
Used in Agrochemical Production:
In the agrochemical industry, (1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate is utilized as a fundamental component in the synthesis of various agrochemicals. Its ability to participate in selective reactions contributes to the development of effective compounds for crop protection and enhancement of agricultural yields.
Used in Organic Synthesis Research:
(1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate is also used as a starting material in academic and industrial research for organic synthesis. Its chiral nature and protected amine group make it an attractive candidate for exploring new synthetic pathways and developing innovative methodologies in organic chemistry.
Used in the Synthesis of Bioactive Molecules:
(1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate is employed as a precursor in the synthesis of bioactive molecules, which have potential applications in medicine, biotechnology, and other life sciences. The versatility of (1S,3R)-methyl 3-(tert-butoxycarbonylamino)cyclohexanecarboxylate allows for the generation of a diverse range of bioactive compounds with possible applications in treating diseases or as probes in biological research.

Check Digit Verification of cas no

The CAS Registry Mumber 930596-35-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 9,3,0,5,9 and 6 respectively; the second part has 2 digits, 3 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 930596-35:
(8*9)+(7*3)+(6*0)+(5*5)+(4*9)+(3*6)+(2*3)+(1*5)=183
183 % 10 = 3
So 930596-35-3 is a valid CAS Registry Number.

930596-35-3Downstream Products

930596-35-3Relevant articles and documents

Pyrimidopyrazole compound, preparation method and application thereof

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Paragraph 0285-0287, (2020/07/21)

The invention discloses a pyrimidopyrazole compound, a preparation method and application thereof. The invention provides a pyrimidopyrazole compound shown as formula I or pharmaceutically acceptablesalts thereof. The compound has a relatively good inhibition effect on CDK7.

INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7)

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Paragraph 178; 179, (2016/12/26)

The present invention provides novel compounds of Formula (I) and pharmaceutically acceptable salts, solvates, hydrates, tautomers, stereoisomers, isotopically labeled derivatives, and compositions thereof. Also provided are methods and kits involving the compounds or compositions for treating or preventing proliferative diseases (e.g., cancers (e.g., leukemia, melanoma, multiple myeloma), benign neoplasms, angiogenesis, inflammatory diseases, autoinflammatory diseases, and autoimmune diseases) in a subject. Treatment of a subject with a proliferative disease using a compound or composition of the invention may inhibit the aberrant activity of cyclin-dependent kinase (e.g., CDK7), and therefore induce cellular apoptosis and/or inhibit transcription in the subject.

INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7)

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Paragraph 542; 543, (2015/11/02)

The present invention provides novel compounds of Formula (I) and Formula (II) and pharmaceutically acceptable salts, solvates, hydrates, tautomers, stereoisomers, isotopically labeled derivatives, and compositions thereof. Also provided are methods and kits involving the compounds or compositions for treating or preventing proliferative diseases (e.g., cancers (e.g., leukemia, melanoma, multiple myeloma), benign neoplasms, angiogenesis, inflammatory diseases, autoinflammatory diseases, and autoimmune diseases) in a subject. Treatment of a subject with a proliferative disease using a compound or composition of the invention may inhibit the aberrant activity of cyclin-dependent kinase 7 (CDK7), and therefore, induce cellular apoptosis and/or inhibit transcription in the subject.

POLYCYCLIC INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7)

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Paragraph 00345, (2015/05/05)

The present invention provides novel compounds of Formula (I), and pharmaceutically acceptable salts, solvates, hydrates, polymorphs, co-crystals, tautomers, stereoisomers, isotopically labeled derivatives, prodrugs, and compositions thereof. Also provided are methods and kits involving the inventive compounds or compositions for treating or preventing proliferative diseases (e.g., cancers (e.g., leukemia, lymphoma, melanoma, multiple myeloma, breast cancer, Ewing' s sarcoma, osteosarcoma, brain cancer, neuroblastoma, lung cancer), benign neoplasms, angiogenesis, inflammatory diseases, autoinflammatory diseases, and autoimmune diseases) in a subject. Treatment of a subject with a proliferative disease using a compound or composition of the invention may inhibit the aberrant activity of a kinase, such as a cyclin-dependent kinase (CDK) (e.g., cyclin-dependent kinase 7 (CDK7), cyclin-dependent kinase 12 (CDK12), or cyclin-dependent kinase 13 (CDK13)), and therefore, induce cellular apoptosis and/or inhibit transcription in the subject.

Methods for inhibiting protein kinases

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Page/Page column 157, (2010/11/26)

The present invention provides methods for inhibiting protein kinases selected from the group consisting of AKT, Checkpoint kinase, Aurora kinase, Pim kinases, and tyrosine kinase using pyrazolo[1,5-a]pyrimidine compounds and methods of treatment, prevent

NOVEL SULFONE AMIDE DERIVATIVES CAPABLE OF INHIBITING BACE

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Page/Page column 147-148, (2010/02/11)

The present invention relates to novel derivatives of sulfone amide of Formula 1 as defined in this disclosure which inhibit the activity of BACE (or beta-secretase). These sulfone amide derivatives are useful for the treatment and prevention of Alzheimer's disease and related diseases caused by production of beta-amyloid, by inhibiting the activity of BACE.

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