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4-Piperidinecarboxylic acid, 1-(1-methylethyl)-(9CI), also known as Isobucic acid or 1-isobutylpiperidine-4-carboxylic acid, is a chemical compound with the molecular formula C9H17NO2. It is a piperidine derivative that contains a carboxylic acid group and an isobutyl group. 4-Piperidinecarboxylicacid,1-(1-methylethyl)-(9CI) has been utilized in the synthesis of pharmaceutical compounds and may have potential applications in the pharmaceutical industry. Due to its potential hazards, it is crucial to handle and use this chemical with caution, adhering to proper safety protocols.

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  • 280771-97-3 Structure
  • Basic information

    1. Product Name: 4-Piperidinecarboxylicacid,1-(1-methylethyl)-(9CI)
    2. Synonyms: 4-Piperidinecarboxylicacid,1-(1-methylethyl)-(9CI);1-isopropylpiperidine-4-carboxylic acid(SALTDATA: HCl);1-isopropylpiperidine-4-carboxylic acid 1HCl;1-(propan-2-yl)piperidine-4-carboxylic acid;1-(1-Methylethyl)-4-piperidinecarboxylic acid;1-isopropyl-4-piperidin-1-iumcarboxylate;1-isopropylpiperidin-1-ium-4-carboxylate;1-propan-2-ylpiperidin-1-ium-4-carboxylate
    3. CAS NO:280771-97-3
    4. Molecular Formula: C9H17NO2
    5. Molecular Weight: 170.25
    6. EINECS: N/A
    7. Product Categories: ISOPROPYL
    8. Mol File: 280771-97-3.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 272℃
    3. Flash Point: 118℃
    4. Appearance: /
    5. Density: 1.057
    6. Vapor Pressure: 0.00179mmHg at 25°C
    7. Refractive Index: 1.487
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. PKA: 4.04±0.20(Predicted)
    11. CAS DataBase Reference: 4-Piperidinecarboxylicacid,1-(1-methylethyl)-(9CI)(CAS DataBase Reference)
    12. NIST Chemistry Reference: 4-Piperidinecarboxylicacid,1-(1-methylethyl)-(9CI)(280771-97-3)
    13. EPA Substance Registry System: 4-Piperidinecarboxylicacid,1-(1-methylethyl)-(9CI)(280771-97-3)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 280771-97-3(Hazardous Substances Data)

280771-97-3 Usage

Uses

Used in Pharmaceutical Industry:
4-Piperidinecarboxylic acid, 1-(1-methylethyl)-(9CI) is used as a chemical intermediate for the synthesis of various pharmaceutical compounds. Its unique structure, which includes a piperidine ring and a carboxylic acid group, allows it to be a versatile building block in the development of new drugs.
Used in Drug Synthesis:
As a piperidine derivative, 4-Piperidinecarboxylic acid, 1-(1-methylethyl)-(9CI) is used in the synthesis of various drug molecules. Its carboxylic acid group can be used to form esters, amides, or other functional groups, enabling the creation of diverse pharmaceutical compounds with potential therapeutic applications.
Used in Medicinal Chemistry Research:
4-Piperidinecarboxylic acid, 1-(1-methylethyl)-(9CI) is utilized in medicinal chemistry research to explore its potential as a lead compound for the development of new drugs. Its unique structure and functional groups make it an interesting candidate for further investigation and optimization to enhance its pharmacological properties.

Check Digit Verification of cas no

The CAS Registry Mumber 280771-97-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,8,0,7,7 and 1 respectively; the second part has 2 digits, 9 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 280771-97:
(8*2)+(7*8)+(6*0)+(5*7)+(4*7)+(3*1)+(2*9)+(1*7)=163
163 % 10 = 3
So 280771-97-3 is a valid CAS Registry Number.
InChI:InChI=1/C9H17NO2/c1-7(2)10-5-3-8(4-6-10)9(11)12/h7-8H,3-6H2,1-2H3,(H,11,12)

280771-97-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-propan-2-ylpiperidine-4-carboxylic acid

1.2 Other means of identification

Product number -
Other names 1-Isopropyl-piperidine-4-carboxylic acid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:280771-97-3 SDS

280771-97-3Relevant articles and documents

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Paragraph 0810-0813; 0819-0823, (2021/01/30)

The invention discloses a generic JAKs inhibitor, and also discloses a composition, a preparation method and medical application of the generic JAKs inhibitor. The definition of each group in the formula is consistent with the specification.

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Page/Page column 30, (2009/04/25)

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