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CAS

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585-81-9

3-HYDROXY-5-METHYL-BENZOIC ACID, also known as 3,5-Cresotic Acid, is an organic compound with the chemical formula C8H8O3. It is a white powder and is a reactant used in the synthesis of various compounds.

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  • 585-81-9 Structure

  • Basic information

    1. Product Name: 3-HYDROXY-5-METHYL-BENZOIC ACID
    2. Synonyms: 3-HYDROXY-5-METHYL-BENZOIC ACID;3,5-Cresotic acid;Aids018040;Aids-018040;Benzoic acid, 3-hydroxy-5-methyl-;3-hydrox-5-methylbenzoic acid;-Hydroxy-5-methylbenzoic acid
    3. CAS NO:585-81-9
    4. Molecular Formula: C8H8O3
    5. Molecular Weight: 152.14732
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 585-81-9.mol

  • Chemical Properties

    1. Melting Point: 210°C
    2. Boiling Point: 234.6°C (rough estimate)
    3. Flash Point: 180.3 °C
    4. Appearance: /
    5. Density: 1.2143 (rough estimate)
    6. Vapor Pressure: 1.58E-05mmHg at 25°C
    7. Refractive Index: 1.4945 (estimate)
    8. Storage Temp.: Inert atmosphere,Room Temperature
    9. Solubility: N/A
    10. PKA: 4.15±0.10(Predicted)
    11. CAS DataBase Reference: 3-HYDROXY-5-METHYL-BENZOIC ACID(CAS DataBase Reference)
    12. NIST Chemistry Reference: 3-HYDROXY-5-METHYL-BENZOIC ACID(585-81-9)
    13. EPA Substance Registry System: 3-HYDROXY-5-METHYL-BENZOIC ACID(585-81-9)

  • 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: 585-81-9(Hazardous Substances Data)

585-81-9 Usage

Uses

Used in Pharmaceutical Industry:
3-HYDROXY-5-METHYL-BENZOIC ACID is used as a reactant for the preparation of trisubstituted benzenes, which serve as thrombin inhibitors. These inhibitors are crucial for the treatment of coagulation disorders, as they help regulate blood clotting and prevent excessive clot formation.
Used in Chemical Synthesis:
3-HYDROXY-5-METHYL-BENZOIC ACID is also used as a building block in the synthesis of various organic compounds, including pharmaceuticals, dyes, and other specialty chemicals. Its versatile structure allows for further functionalization and modification to create a wide range of products with different applications.

Check Digit Verification of cas no

The CAS Registry Mumber 585-81-9 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 5,8 and 5 respectively; the second part has 2 digits, 8 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 585-81:
(5*5)+(4*8)+(3*5)+(2*8)+(1*1)=89
89 % 10 = 9
So 585-81-9 is a valid CAS Registry Number.
InChI:InChI=1/C8H8O3/c1-5-2-6(8(10)11)4-7(9)3-5/h2-4,9H,1H3,(H,10,11)

585-81-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-Hydroxy-5-methylbenzoic acid

1.2 Other means of identification

Product number -
Other names Benzoic acid, 3-hydroxy-5-methyl-

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:585-81-9 SDS

585-81-9Relevant articles and documents

ARYL SULFONOHYDRAZIDES

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Page/Page column 40; 47, (2016/12/26)

Compound of formula (I) wherein A is selected from (i), where RF1 is H or F; (ii); (iii) a N-containing C6 heteroaryl group; and B is (B), where X1 is either CRF2 or N, where RF2 is H or F; X2 is either CR3 or N, where R3 is selected from H, Me, CI, F OMe; X3 is either CH or N; X4 is either CRF3 or N, where RF3 is H or F; where only one or two of X1, X2, X3 and X4 may be N; and R4 is selected from I, optionally substituted phenyl, optionally substituted C5-6 heteroaryl; optionally substituted C1-6 aIkyI and optionally substituted C1-6 alkoxy, which are useful in the treatment of a condition ameliorated by the inhibition of MOZ.

THIAZOLE AND OXAZOLE KINASE INHIBITORS

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Page/Page column 136, (2009/04/25)

The present invention provides thiazole and oxazole compounds, compositions containing the same, as well as processes for the preparation and methods for their use as pharmaceutical agents.

2,5-diamino-3,4-disubstituted-1,6-diphenylhexane isosteres comprising benzamide, sulfonamide and anthranilamide subunits and methods of using same

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, (2008/06/13)

The present invention provides 2,5-diamino-3,4-disubstituted-1,6-diphenylhexane (DAD) isosteres comprising benzamide, sulfonamide and anthranilamide subunits, a pharmaceutical composition comprising such compounds, a method of using such compounds to treat retroviral, specifically HIV and more specifically HIV-1 and HIV-2, infections in mammals, particularly humans, a method of synthesizing asymmetric DAD isosteres comprising benzamide, sulfonamide and anthranilamide subunits, and a method of using such compounds to assay new compounds for antiretroviral activity.

Three New Phytotoxins Produced by Pyrenochaeta terrestris: Pyrenochaetic Acids A, B and C

Sato, Hiroji,Konoma, Keiichi,Sakamura, Sadao

, p. 1675 - 1680 (2007/10/02)

Three phytotoxins named pyrenochaetic acids A, B and C were isolated from culture filtrates of Pyrenochaeta terrestris, and the structures were determined to be 4-crotonoyl-3-methoxy-5-methylbenzoic acid (I), 4-(3-hydroxybutyroyl)-3-methoxy-5-methylbenzoi

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