Cas no 518979-12-9 (BENZENEACETIC ACID, 5-FLUORO-2-METHOXY-, METHYL ESTER)

Benzeneacetic acid, 5-fluoro-2-methoxy-, methyl ester is a fluorinated aromatic ester with potential applications in pharmaceutical and agrochemical synthesis. Its structure incorporates a methoxy and a fluorine substituent on the benzene ring, enhancing its reactivity and selectivity in organic transformations. The methyl ester group improves solubility in organic solvents, facilitating its use as an intermediate in coupling reactions or derivatization processes. The fluorine moiety may contribute to increased metabolic stability in bioactive compounds. This compound is suitable for research and development purposes, particularly in the design of fluorinated analogs for medicinal chemistry or crop protection agents. Proper handling is required due to its synthetic nature.
BENZENEACETIC ACID, 5-FLUORO-2-METHOXY-, METHYL ESTER structure
518979-12-9 structure
Product Name:BENZENEACETIC ACID, 5-FLUORO-2-METHOXY-, METHYL ESTER
CAS No:518979-12-9
MF:C10H11FO3
MW:198.190946817398
CID:3371657
PubChem ID:82112255
Update Time:2025-05-23

BENZENEACETIC ACID, 5-FLUORO-2-METHOXY-, METHYL ESTER Chemical and Physical Properties

Names and Identifiers

    • BENZENEACETIC ACID, 5-FLUORO-2-METHOXY-, METHYL ESTER
    • (5-Fluoro-2-methoxy-phenyl)-acetic acid methyl ester
    • SCHEMBL23362766
    • Methyl (5-fluoro-2-methoxyphenyl)acetate
    • Methyl 5-fluoro-2-methoxyphenylacetate
    • 518979-12-9
    • Inchi： 1S/C10H11FO3/c1-13-9-4-3-8(11)5-7(9)6-10(12)14-2/h3-5H,6H2,1-2H3
    • InChI Key： CLQOMKBGCLHDPZ-UHFFFAOYSA-N
    • SMILES： C1(CC(OC)=O)=CC(F)=CC=C1OC

Computed Properties

  • Exact Mass: 198.06922237Da
  • Monoisotopic Mass: 198.06922237Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 196
  • 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: 1.8
  • Topological Polar Surface Area: 35.5?2

BENZENEACETIC ACID, 5-FLUORO-2-METHOXY-, METHYL ESTER Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
A2B Chem LLC
AG34801-1g
(5-Fluoro-2-methoxy-phenyl)-acetic acid methyl ester
 518979-12-9 98%
1g
 $480.00 2024-04-19
A2B Chem LLC
AG34801-5g
(5-Fluoro-2-methoxy-phenyl)-acetic acid methyl ester
 518979-12-9 98%
5g
 $1480.00 2024-04-19

BENZENEACETIC ACID, 5-FLUORO-2-METHOXY-, METHYL ESTER Related Literature

518979-12-9 (BENZENEACETIC ACID, 5-FLUORO-2-METHOXY-, METHYL ESTER) Related Products

Recommended suppliers
Zouping Mingyuan Import and Export Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Zouping Mingyuan Import and Export Trading Co., Ltd
Jiangxi Boyang Pharmaceutical Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangxi Boyang Pharmaceutical Chemical Co., Ltd
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
SHOCHEM(SHANGHAI) CO.,lTD
Zhangzhou Sinobioway Peptide Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Zhangzhou Sinobioway Peptide Co.,Ltd.
Handan Zechi Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk