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3-(PYRROLIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE, with the molecular formula C15H20ClNO2, is an organic compound that features a benzoic acid core and a pyrrolidine moiety. This hydrochloride salt form of the compound is known for its enhanced solubility in water and improved stability, making it a valuable precursor in the synthesis of pharmaceutical drugs and a promising candidate in medicinal chemistry.

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  • 887922-93-2 Structure
  • Basic information

    1. Product Name: 3-(PYRROLIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE
    2. Synonyms: 3-(PYRROLIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE;3-(1-Pyrrolidylmethyl)benzoic Acid Hydrochloride;3-(Pyrrolidin-1-ylmethyl)
    3. CAS NO:887922-93-2
    4. Molecular Formula: C12H15NO2*ClH
    5. Molecular Weight: 241.71394
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 887922-93-2.mol
  • Chemical Properties

    1. Melting Point: 168 °C
    2. Boiling Point: 377°C at 760 mmHg
    3. Flash Point: 181.8°C
    4. Appearance: /
    5. Density: N/A
    6. Vapor Pressure: 2.35E-06mmHg at 25°C
    7. Refractive Index: N/A
    8. Storage Temp.: Inert atmosphere,Room Temperature
    9. Solubility: N/A
    10. CAS DataBase Reference: 3-(PYRROLIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE(CAS DataBase Reference)
    11. NIST Chemistry Reference: 3-(PYRROLIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE(887922-93-2)
    12. EPA Substance Registry System: 3-(PYRROLIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE(887922-93-2)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: 41
    3. Safety Statements: 26-39
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 887922-93-2(Hazardous Substances Data)

887922-93-2 Usage

Uses

Used in Pharmaceutical Synthesis:
3-(PYRROLIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE is used as a precursor in the synthesis of various pharmaceutical drugs for its ability to contribute to the formation of complex molecular structures that can exhibit therapeutic effects.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 3-(PYRROLIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE is utilized as a building block for the development of new compounds with potential medicinal properties, leveraging its structural features to create novel therapeutic agents.
Safety Considerations:
It is crucial to handle 3-(PYRROLIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE with care, adhering to proper safety protocols and guidelines to mitigate any potential hazards associated with its use in chemical and pharmaceutical processes.

Check Digit Verification of cas no

The CAS Registry Mumber 887922-93-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 8,8,7,9,2 and 2 respectively; the second part has 2 digits, 9 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 887922-93:
(8*8)+(7*8)+(6*7)+(5*9)+(4*2)+(3*2)+(2*9)+(1*3)=242
242 % 10 = 2
So 887922-93-2 is a valid CAS Registry Number.
InChI:InChI=1/C12H15NO2.ClH/c14-12(15)11-5-3-4-10(8-11)9-13-6-1-2-7-13;/h3-5,8H,1-2,6-7,9H2,(H,14,15);1H

887922-93-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-(pyrrolidin-1-ylmethyl)benzoic acid,hydrochloride

1.2 Other means of identification

Product number -
Other names AC-7378

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:887922-93-2 SDS

887922-93-2Relevant articles and documents

SUBSTITUTED PYRROLO-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS

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Page/Page column 50, (2008/06/13)

Substituted pyrrolo-pyrazole derivatives of formula (I) and pharmaceutically acceptable salts thereof, as defined in the specification, process for their preparation and 5 pharmaceutical compositions comprising them are disclosed; the compounds of the inv

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