Cas no 1375064-45-1 (5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid)

5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid is a versatile heterocyclic compound featuring both an isoxazole core and a cyano-substituted phenyl group. This structure imparts reactivity suitable for further functionalization, making it valuable in pharmaceutical and agrochemical research. The carboxylic acid moiety allows for derivatization via esterification or amidation, while the cyano group offers additional modification potential. Its rigid aromatic framework contributes to stability, and the compound serves as a key intermediate in synthesizing biologically active molecules. High purity grades are available for precision applications. Suitable for use in medicinal chemistry, it is often employed in the development of enzyme inhibitors or receptor modulators.
5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid structure
1375064-45-1 structure
Product Name:5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid
CAS No:1375064-45-1
MF:C11H6N2O3
MW:214.17694234848
MDL:MFCD22192327
CID:1056711
PubChem ID:68158423
Update Time:2025-06-08

5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • 5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid
    • 5-(4-Cyanophenyl)-1,2-oxazole-3-carboxylic acid
    • AMTDA011
    • MDL： MFCD22192327
    • Inchi： 1S/C11H6N2O3/c12-6-7-1-3-8(4-2-7)10-5-9(11(14)15)13-16-10/h1-5H,(H,14,15)
    • InChI Key： PDHRXDLHPHLFEX-UHFFFAOYSA-N
    • SMILES： O1C(=CC(C(=O)O)=N1)C1C=CC(C#N)=CC=1

Computed Properties

  • Exact Mass: 214.03800
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2

Experimental Properties

  • PSA: 87.12000
  • LogP: 1.91148

5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB451488-250 mg
5-(4-Cyanophenyl)isoxazole-3-carboxylic acid, 97%; .
 1375064-45-1 97%
250mg
 €274.90 2023-06-15
abcr
AB451488-1 g
5-(4-Cyanophenyl)isoxazole-3-carboxylic acid, 97%; .
 1375064-45-1 97%
1g
 €720.90 2023-06-15
TRC
C998673-50mg
5-(4-Cyanophenyl)Isoxazole-3-Carboxylic Acid
 1375064-45-1
50mg
 $ 50.00 2022-06-06
TRC
C998673-100mg
5-(4-Cyanophenyl)Isoxazole-3-Carboxylic Acid
 1375064-45-1
100mg
 $ 65.00 2022-06-06
TRC
C998673-500mg
5-(4-Cyanophenyl)Isoxazole-3-Carboxylic Acid
 1375064-45-1
500mg
 $ 210.00 2022-06-06
Chemenu
CM320415-5g
5-(4-cyanophenyl)isoxazole-3-carboxylic acid
 1375064-45-1 95%
5g
 $400 2021-08-18
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
D851882-5g
5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid
 1375064-45-1 ≥97%
5g
 3,174.00 2021-05-17
Chemenu
CM320415-1g
5-(4-cyanophenyl)isoxazole-3-carboxylic acid
 1375064-45-1 95%
1g
 $*** 2023-03-30
eNovation Chemicals LLC
D691060-0.25g
5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid
 1375064-45-1 >97%
0.25g
 $150 2024-07-20
eNovation Chemicals LLC
D691060-1g
5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid
 1375064-45-1 >97%
1g
 $210 2024-07-20

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