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Methyl 2-chloropyrimidine-5-carboxylate is an organic compound with the chemical formula C6H5ClN2O2. It is a white to off-white powder and is known for its potential applications in the pharmaceutical industry.

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  • 287714-35-6 Structure
  • Basic information

    1. Product Name: METHYL 2-CHLOROPYRIMIDINE-5-CARBOXYLATE
    2. Synonyms: METHYL 2-CHLOROPYRIMIDINE-5-CARBOXYLATE;Methyl 2-chloropyriMidine...;2-Chloropyrimidine-5-carboxylic acid methyl ester;2-Chloro-5-(methoxycarbonyl)pyrimidine, 2-Chloro-5-(methoxycarbonyl)-1,3-diazine;2-chloro-pyrimidine-5-carboxylic acid methyl este;EOS-60344
    3. CAS NO:287714-35-6
    4. Molecular Formula: C6H5ClN2O2
    5. Molecular Weight: 172.5691
    6. EINECS: N/A
    7. Product Categories: Heterocycles;Heterocycle-Pyrimidine series
    8. Mol File: 287714-35-6.mol
  • Chemical Properties

    1. Melting Point: 76 °C
    2. Boiling Point: 304.3℃
    3. Flash Point: 138℃
    4. Appearance: White to off-white powder
    5. Density: 1.372
    6. Vapor Pressure: 0.000883mmHg at 25°C
    7. Refractive Index: 1.534
    8. Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
    9. Solubility: N/A
    10. PKA: -3.14±0.22(Predicted)
    11. CAS DataBase Reference: METHYL 2-CHLOROPYRIMIDINE-5-CARBOXYLATE(CAS DataBase Reference)
    12. NIST Chemistry Reference: METHYL 2-CHLOROPYRIMIDINE-5-CARBOXYLATE(287714-35-6)
    13. EPA Substance Registry System: METHYL 2-CHLOROPYRIMIDINE-5-CARBOXYLATE(287714-35-6)
  • Safety Data

    1. Hazard Codes: Xn
    2. Statements: 20/21/22-36/37/38
    3. Safety Statements: 22-26-36/37/39
    4. RIDADR: UN2811
    5. WGK Germany:
    6. RTECS:
    7. HazardClass: N/A
    8. PackingGroup: N/A
    9. Hazardous Substances Data: 287714-35-6(Hazardous Substances Data)

287714-35-6 Usage

Uses

Used in Pharmaceutical Industry:
Methyl 2-chloropyrimidine-5-carboxylate is used as a key intermediate in the synthesis of ACSS2 inhibitors. These inhibitors exhibit anti-inflammatory and anti-depressant activity, making them valuable for the development of new therapeutic agents to treat various inflammatory and mood disorders.

Check Digit Verification of cas no

The CAS Registry Mumber 287714-35-6 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,8,7,7,1 and 4 respectively; the second part has 2 digits, 3 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 287714-35:
(8*2)+(7*8)+(6*7)+(5*7)+(4*1)+(3*4)+(2*3)+(1*5)=176
176 % 10 = 6
So 287714-35-6 is a valid CAS Registry Number.
InChI:InChI=1/C6H5ClN2O2/c1-11-5(10)4-2-8-6(7)9-3-4/h2-3H,1H3

287714-35-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl 2-chloropyrimidine-5-carboxylate

1.2 Other means of identification

Product number -
Other names methyl-2-chloropyrimidine-5-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:287714-35-6 SDS

287714-35-6Relevant articles and documents

COMBINATION THERAPY WITH A PHOSPHOINOSITIDE 3-KINASE INHIBITOR WITH A ZINC BINDING MOIETY

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Paragraph 0088; 0095, (2020/04/09)

The invention provides a method of treating cancer in a subject in need thereof, comprising administering to the subject: (a) a compound of Formula I: or a pharmaceutically acceptable salt thereof, wherein R is hydrogen or an acyl group; and (b) a PD-1 signaling inhibitor; wherein the compound of Formula I or pharmaceutically acceptable salt thereof and the PD-1 signaling inhibitor are administered in amounts which in combination are therapeutically effective. The invention further provides a pharmaceutical composition comprising a compound of Formula I or a pharmaceutically acceptable salt thereof, a PD-1 signaling inhibitor and a pharmaceutically acceptable carrier or excipient.

COMBINATION THERAPY WITH A PHOSPHOINOSITIDE 3-KINASE INHIBITOR WITH A ZINC BINDING MOIETY

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Page/Page column 26; 28; 29, (2018/05/24)

The invention provides a method of treating cancer in a subject in need thereof, comprising administering to the subject: (a) a compound of Formula I: or a pharmaceutically acceptable salt thereof, wherein R is hydrogen or an acyl group; and (b) a BCL-2 inhibitor; wherein the compound of Formula I or pharmaceutically acceptable salt thereof and a BCL-2 inhibitor are administered in amounts which in combination are therapeutically effective. The invention further provides a pharmaceutical composition comprising a compound of Formula I or a pharmaceutically acceptable salt thereof, a BCL-2 inhibitor and a pharmaceutically acceptable carrier or excipient.

CONDENSED BICYCLIC HETEROCYCLIC DERIVATIVE

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Paragraph 0500; 0502, (2018/09/12)

PROBLEM TO BE SOLVED: To provide a compound having excellent retinoic acid receptor related orphan receptor γt inhibition effect and useful as a therapeutic agent for psoriasis or the like. SOLUTION: There is provided a compound represented by the general

Phosphoinositide 3-kinase inhibitor with a zinc binding moiety

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Page/Page column 35, (2016/02/26)

The invention provides a compound of Formula I, Pharmaceutical compositions comprising such compounds and the use of such compounds in the treatment of phosphoinositide 3-kinase related diseases and disorders such as cancer. The instant application further relates to the treatment of histone deacetylase related disorders and diseases related to both histone deacetylase and phosphoinositide 3-kinase.

HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES

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Paragraph 0162; 0179, (2014/02/16)

The present invention provides compounds which antagonize hedgehog signaling and inhibit HDAC activity. The com-pounds can be used in methods of treating proliferative dis-eases and disorders such as cancer

AZACYCLOALKANE DERIVATIVES AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE

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Page/Page column 40, (2008/12/05)

Azacycloalkane derivatives of structural formula (I) are selective inhibitors of stearoyl-coenzyme A delta-9 desaturase (SCD1) relative to other known stearoyl-coenzyme A desaturases. The compounds of the present invention are useful for the prevention and treatment of conditions related to abnormal lipid synthesis and metabolism, including cardiovascular disease, such as atherosclerosis; obesity; diabetes; neurological disease; metabolic syndrome; insulin resistance; and liver steatosis.

CETP INHIBITORS DERIVED FROM BENZOXAZOLE ARYLAMIDES

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Page/Page column 67, (2009/01/23)

Compounds having the structure of Formula I1 including pharmaceutically acceptable salts of the compounds, are potent CETP (cholesterol ester transfer protein) inhibitors, and are useful for raising HDL-cholesterol, reducing LDL-cholesterol, and for treating or preventing atherosclerosis Atherosclerosis and its clinical consequences, coronary heart disease (CHD), stroke and penpheral vascular disease, represent a truly enormous burden to the health care systems ofthe industrialized world In formula I, A-B is an arylamide moiety

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