Cas no 26584-27-0 (Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester)

Benzoic acid, 3-fluoro-2,4-dimethyl-, methyl ester is a fluorinated aromatic ester with the molecular formula C10H11FO2. This compound features a benzoic acid backbone substituted with a fluorine atom at the 3-position and methyl groups at the 2- and 4-positions, esterified with a methyl group. The presence of the fluorine atom enhances its electron-withdrawing properties, making it useful in organic synthesis, particularly as an intermediate in pharmaceuticals and agrochemicals. The methyl ester group improves solubility in organic solvents, facilitating reactions such as nucleophilic substitution or coupling. Its structural rigidity and fluorinated moiety contribute to stability and reactivity, making it valuable for designing bioactive molecules or fine chemicals. The compound is typically characterized by NMR and mass spectrometry for purity verification.

Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester structure

26584-27-0 structure

Product Name:Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester

CAS No:26584-27-0

MF:C₁₀H₁₁FO₂

MW:182.191546678543

MDL:MFCD04972917

CID:249818

PubChem ID:40427145

Update Time:2025-07-02

Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester Chemical and Physical Properties

Names and Identifiers

- Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester
- 2,4-DIMETHYL-3-FLUOROBENZOIC ACID METHYL ESTER
- Methyl 2,4-diMethyl-3-fluorobenzoate
- methyl 3-fluoro-2,4-dimethylbenzoate
- 3-fluoro-2,4-dimethyl-benzoic acid methyl ester
- Methyl-3-fluor-2,4-dimethylbenzoat
- FT-0693542
- E89794
- 2,4-DIMETHYL-3-FLUOROBENZOICACIDMETHYLESTER
- DTXSID90654253
- MFCD04972917
- CS-0193701
- 3-Fluoro-2,4-dimethylbenzoic acid methyl ester
- AKOS006344211
- methyl 3-fluoro-2, 4-dimethylbenzoate
- 26584-27-0
- Benzoic acid, 3-fluoro-2,4-dimethyl-, methyl ester
- MDL： MFCD04972917
- Inchi： 1S/C10H11FO2/c1-6-4-5-8(10(12)13-3)7(2)9(6)11/h4-5H,1-3H3
- InChI Key： ACOITQPWFKGOIV-UHFFFAOYSA-N
- SMILES： FC1=C(C)C=CC(C(=O)OC)=C1C

Computed Properties

Exact Mass: 182.07400
Monoisotopic Mass: 182.07430775g/mol
Isotope Atom Count: 0
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 2
Heavy Atom Count: 13
Rotatable Bond Count: 2
Complexity: 193
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count : 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 2.6
Topological Polar Surface Area: 26.3?2

Experimental Properties

PSA: 26.30000
LogP: 2.22910

Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester Security Information

Hazard Category Code： 36/37/38
Safety Instruction： S26; S36/37/39
Risk Phrases：R36/37/38

Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester Customs Data

HS CODE：2916399090
Customs Data：

China Customs Code:
2916399090

Overview:

2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

Declaration elements:

Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly

Summary:

2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester Pricemore >>

Related Categories	No.	Product Name	Cas No.	Purity	Specification	Price	update time
Fluorochem	033028-250mg	2,4-Dimethyl-3-fluorobenzoic acid methyl ester	26584-27-0		250mg	￡160.00	2022-03-01
Fluorochem	033028-2g	2,4-Dimethyl-3-fluorobenzoic acid methyl ester	26584-27-0		2g	￡731.00	2022-03-01
Alichem	A015013574-250mg	Methyl 2,4-dimethyl-3-fluorobenzoate	26584-27-0	97%	250mg	$489.60	2023-09-02
Alichem	A015013574-500mg	Methyl 2,4-dimethyl-3-fluorobenzoate	26584-27-0	97%	500mg	$798.70	2023-09-02
Alichem	A015013574-1g	Methyl 2,4-dimethyl-3-fluorobenzoate	26584-27-0	97%	1g	$1490.00	2023-09-02
Fluorochem	033028-1g	2,4-Dimethyl-3-fluorobenzoic acid methyl ester	26584-27-0		1g	￡465.00	2022-03-01
abcr	AB146414-1 g	Methyl 2,4-dimethyl-3-fluorobenzoate, 98%; .	26584-27-0	98%	1g	€315.00	2022-06-02
Aaron	AR002UGJ-500mg	Benzoic acid, 3-fluoro-2,4-dimethyl-, methyl ester	26584-27-0	95%	500mg	$344.00	2025-02-12
Aaron	AR002UGJ-1g	Benzoic acid, 3-fluoro-2,4-dimethyl-, methyl ester	26584-27-0	95%	1g	$458.00	2025-02-12
abcr	AB146414-5g	Methyl 2,4-dimethyl-3-fluorobenzoate, 98%; .	26584-27-0	98%	5g	€775.00	2024-04-18

Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester Suppliers

Amadis Chemical Company Limited

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(CAS:26584-27-0)Benzoic acid,3-fluoro-2,4-dimethyl-, methyl ester

Order Number:A1147387

Stock Status:in Stock

Quantity:1g

Purity:99%

Pricing Information Last Updated:Thursday, 29 August 2024 23:06

Price ($):378.0

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