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4-methoxybutyric acid, also known as pivalic acid, is a carboxylic acid derivative with the chemical formula C4H8O2. It is a colorless liquid with a fruity odor, soluble in water and organic solvents, and is recognized for its antimicrobial and anti-inflammatory properties. This versatile building block in organic chemistry is commonly used in the production of pharmaceuticals, perfumes, and agricultural chemicals, and has been studied for its potential applications in the synthesis of various drugs and other bioactive compounds.

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  • 29006-02-8 Structure
  • Basic information

    1. Product Name: 4-methoxybutyric acid
    2. Synonyms: Einecs 249-366-5;4-methoxybutyric acid;4-Methoxybutanoic acid
    3. CAS NO:29006-02-8
    4. Molecular Formula: C5H10O3
    5. Molecular Weight: 118.1311
    6. EINECS: 249-366-5
    7. Product Categories: N/A
    8. Mol File: 29006-02-8.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 218.4 °C at 760 mmHg
    3. Flash Point: 91.6 °C
    4. Appearance: /
    5. Density: 1.054 g/cm3
    6. Vapor Pressure: 0.0478mmHg at 25°C
    7. Refractive Index: 1.422
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 4-methoxybutyric acid(CAS DataBase Reference)
    11. NIST Chemistry Reference: 4-methoxybutyric acid(29006-02-8)
    12. EPA Substance Registry System: 4-methoxybutyric acid(29006-02-8)
  • 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: 29006-02-8(Hazardous Substances Data)

29006-02-8 Usage

Uses

Used in Pharmaceutical Industry:
4-methoxybutyric acid is used as an intermediate in the synthesis of various drugs and bioactive compounds for its ability to enhance the antimicrobial and anti-inflammatory properties of pharmaceutical formulations.
Used in Perfume Industry:
4-methoxybutyric acid is used as a fragrance ingredient for its fruity odor, contributing to the creation of unique and appealing scents in perfumes and other fragranced products.
Used in Agricultural Chemicals:
4-methoxybutyric acid is used as a component in the development of agricultural chemicals, leveraging its antimicrobial properties to protect crops and enhance agricultural productivity.
Used in Organic Chemistry:
4-methoxybutyric acid is used as a versatile building block in organic chemistry for its ability to be incorporated into a wide range of chemical reactions and the synthesis of various compounds, making it a valuable asset in the development of new chemical products.

Check Digit Verification of cas no

The CAS Registry Mumber 29006-02-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 2,9,0,0 and 6 respectively; the second part has 2 digits, 0 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 29006-02:
(7*2)+(6*9)+(5*0)+(4*0)+(3*6)+(2*0)+(1*2)=88
88 % 10 = 8
So 29006-02-8 is a valid CAS Registry Number.
InChI:InChI=1/C5H10O3/c1-8-4-2-3-5(6)7/h2-4H2,1H3,(H,6,7)

29006-02-8SDS

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 4-methoxybutanoic acid

1.2 Other means of identification

Product number -
Other names Butanoic acid,4-methoxy

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:29006-02-8 SDS

29006-02-8Relevant articles and documents

Directed γ-C(sp3)-H Alkylation of Carboxylic Acid Derivatives through Visible Light Photoredox Catalysis

Chen, Dian-Feng,Chu, John C. K.,Rovis, Tomislav

supporting information, p. 14897 - 14900 (2017/10/31)

Visible light photoredox catalysis enables direct γ- C(sp3)-H alkylation of saturated aliphatic carbonyl compounds. Electron-deficient alkenes are used as the coupling partners in this reaction. Distinguished site selectivity is controlled by the predominant 1,5-hydrogen atom transfer of an amidyl radical generated in situ.

2-AMINO-1,3,4-THIADIAZINE AND 2-AMINO-1,3,4-OXADIAZINE BASED ANTIFUNGAL AGENTS

-

Page/Page column 59, (2017/02/09)

The invention provides a compound which is a diazine of formula (I) or a tautomer thereof, or a pharmaceutically acceptable salt thereof, for use as an antifungal agent: (I) wherein X, N', C', A and E are as defined herein. The invention also provides a compound of Formula (I) as defined herein.

NOVEL COMPOUNDS

-

Page/Page column 52, (2015/12/17)

Disclosed are novel retinoid-related orphan receptor gamma (RORγ) modulators and their use in the treatment of diseases mediated by RORγ.

N-Acyl-N'-(pyridin-2-yl) Ureas and Analogs Exhibiting Anti-Cancer and Anti-Proliferative Activities

-

Paragraph 0446, (2014/09/30)

Described are compounds of Formula I which find utility in the treatment of cancer, autoimmune diseases and metabolic bone disorders through inhibition of c-FMS (CSF-1R), c-KIT, and/or PDGFR kinases. These compounds also find utility in the treatment of other mammalian diseases mediated by c-FMS, c-KIT, or PDGFR kinases.

QUINOLINE DERIVATIVES USED TO TREAT INFLAMMATORY AND ALLERGIC DISEASES

-

Page/Page column 62, (2009/05/28)

The present invention relates to compounds of formula (I) and salts thereof, processes for their preparation, to compositions containing them and to their use in the treatment of various diseases, such as allergic rhinitis.

Raf inhibitor compounds and methods of use thereof

-

Page/Page column 90, (2010/11/26)

Compounds of Formula I are useful for inhibiting Raf kinase and for treating disorders mediated thereby. Methods of using compounds of Formula I, and stereoisomers, geometric isomers, tautomers, solvates and pharmaceutically acceptable salts thereof, for in vitro, in situ, and in vivo diagnosis, prevention or treatment of such disorders in mammalian cells, or associated pathological conditions are disclosed.

Ether-directed palladium(II)-catalysed aza-Claisen rearrangements: studies on the origin of the directing effect

Jamieson, Andrew G.,Sutherland, Andrew

, p. 2123 - 2131 (2007/10/03)

Four new chiral δ-substituted allylic trichloroacetimidates have been synthesised to probe the origin of the high diastereoselectivity observed for the MOM-ether directed palladium(II)-catalysed aza-Claisen rearrangement. Rearrangement of these compounds has not only provided strong evidence for this directing effect but also that during the rearrangement both oxygen atoms from the MOM-ether are involved in coordinating to and directing the palladium(II) catalyst.

Heterocycles as nicotinic acid receptor agonists for the treatment of dyslipidemia

-

Page/Page column 87, (2008/06/13)

A compound having the general structure of Formula (I): or a pharmaceutically acceptable salt, solvate, ester, or tautomer thereof, wherein: Q is selected from the group consisting of: and L is selected from the group consisting of: or a pharmaceutically acceptable salt, solvate, ester, or tautomer thereof, are useful in treating diseases, disorders, or conditions such as metabolic syndrome and dyslipidemia.

ESTER DERIVATIVES OF RHEIN AND THEIR THERAPEUTIC USE

-

Page/Page column 11-12, (2008/06/13)

Compounds that may have anti-inflammatory activity are of general formula (I); wherein X1, is H or COR1, and X2 is H or COR2 but X1, and X2are not both H; R1 and R2 are the same or different and are each C1-4 alkyl substituted with R3, or a four to seven-membered ring which can be optionally substituted with R8 and can contain one or more additional heteroatoms selected from O, S(O)n and NR9; is R3 is F, CF3, OR4, NR5R6 O, S(O)n R7 ; R4, R5 and R6 are the same or different and are each H or C1-4 alkyl optionally substituted with R3, or NR5R6 is a C4-6 heterocycloalkyl ring containing one or more heteroatoms selected from O, NR8 and S(O)n; each n is 0-2; R7 is C1-4 alkyl; R8 is as defined for R3 or C1-4 alkyl optionally substituted with R3 or halogen; and R9 is H or C1-4 alkyl; or a salt, solvate or hydrate thereof.

Novel water soluble 2,6-dimethoxyphenyl ester derivatives with intravenous anaesthetic activity

Bennett, D. Jonathan,Anderson, Alison,Buchanan, Kirsteen,Byford, Alan,Cooke, Andrew,Gemmell, David K.,Hamilton, Niall M.,Maidment, Maurice S.,McPhail, Petula,Stevenson, Donald F. M.,Sundaram, Hardy,Vijn, Peter

, p. 1971 - 1975 (2007/10/03)

A number of water soluble bis-amino-2,6-dimethoxyphenyl ester derivatives were found to exhibit improved anaesthetic activity in mice relative to propofol 1. Of the analogues disclosed, 44 was further profiled in rodents and found to be a superior agent to propofol for the induction and maintenance of anaesthesia.

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