Cas no 1375109-00-4 ((2-cyano-5-methylphenyl)boronic acid)

(2-Cyano-5-methylphenyl)boronic acid is a boronic acid derivative featuring a cyano substituent at the ortho position and a methyl group at the meta position relative to the boronic acid functionality. This compound serves as a versatile intermediate in Suzuki-Miyaura cross-coupling reactions, enabling the synthesis of biaryl structures with high selectivity and efficiency. The electron-withdrawing cyano group enhances reactivity in palladium-catalyzed transformations, while the methyl group contributes to steric and electronic modulation. Its stability under anhydrous conditions and compatibility with diverse reaction conditions make it a valuable reagent for pharmaceutical and materials science applications. Proper handling under inert atmospheres is recommended to preserve its integrity.
(2-cyano-5-methylphenyl)boronic acid structure
1375109-00-4 structure
Product Name:(2-cyano-5-methylphenyl)boronic acid
CAS No:1375109-00-4
MF:C8H8BNO2
MW:160.965621948242
MDL:MFCD18394415
CID:3165367
PubChem ID:91828113
Update Time:2025-10-29

(2-cyano-5-methylphenyl)boronic acid Chemical and Physical Properties

Names and Identifiers

    • (2-cyano-5-methylphenyl)boronic acid
    • 2-Cyano-5-methyl-phenylboronic acid
    • (2-cyano-5-Methylphenyl)boronicacid
    • SB33200
    • Boronic acid, B-(2-cyano-5-methylphenyl)-
    • MFCD18394415
    • 1375109-00-4
    • F90185
    • EN300-182982
    • 2-Cyano-5-methylphenylboronic acid
    • MDL: MFCD18394415
    • Inchi: 1S/C8H8BNO2/c1-6-2-3-7(5-10)8(4-6)9(11)12/h2-4,11-12H,1H3
    • InChI Key: SHYMGMXUILFDCY-UHFFFAOYSA-N
    • SMILES: OB(C1=C(C#N)C=CC(C)=C1)O

Computed Properties

  • Exact Mass: 161.0648087Da
  • Monoisotopic Mass: 161.0648087Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 198
  • 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
  • Topological Polar Surface Area: 64.3?2

(2-cyano-5-methylphenyl)boronic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd.
32R0193-1g
2-Cyano-5-methyl-phenylboronic acid
1375109-00-4 97%
1g
2527.17CNY 2021-05-07
JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd.
32R0193-5g
2-Cyano-5-methyl-phenylboronic acid
1375109-00-4 97%
5g
10108.67CNY 2021-05-07
JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd.
32R0193-500mg
2-Cyano-5-methyl-phenylboronic acid
1375109-00-4 97%
500mg
1679.12CNY 2021-05-07
JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd.
32R0193-250mg
2-Cyano-5-methyl-phenylboronic acid
1375109-00-4 97%
250mg
1263.58CNY 2021-05-07
JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd.
32R0193-100mg
2-Cyano-5-methyl-phenylboronic acid
1375109-00-4 97%
100mg
1060.05CNY 2021-05-07
JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd.
32R0193-50mg
2-Cyano-5-methyl-phenylboronic acid
1375109-00-4 97%
50mg
831.08CNY 2021-05-07
Chemenu
CM208544-1g
(2-Cyano-5-methylphenyl)boronic acid
1375109-00-4 97%
1g
$623 2022-09-03
eNovation Chemicals LLC
Y0990433-5g
(2-cyano-5-Methylphenyl)boronic acid
1375109-00-4 95%
5g
$1600 2024-08-02
eNovation Chemicals LLC
Y1124656-100mg
2-Cyano-5-methyl-phenylboronic acid
1375109-00-4 95%
100mg
$190 2024-07-28
eNovation Chemicals LLC
Y1124656-250mg
2-Cyano-5-methyl-phenylboronic acid
1375109-00-4 95%
250mg
$185 2024-07-28

Additional information on (2-cyano-5-methylphenyl)boronic acid

Comprehensive Overview of (2-Cyano-5-methylphenyl)boronic Acid (CAS No. 1375109-00-4): Properties, Applications, and Industry Insights

(2-Cyano-5-methylphenyl)boronic acid (CAS No. 1375109-00-4) is a specialized boronic acid derivative that has garnered significant attention in pharmaceutical and material science research. This compound, characterized by its cyano (-CN) and methyl (-CH3) functional groups, serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, a cornerstone of modern organic synthesis. Its unique structure enables precise molecular modifications, making it invaluable for developing targeted therapeutics and advanced materials.

In recent years, the demand for boronic acid-based compounds like 1375109-00-4 has surged due to their role in drug discovery, particularly for kinase inhibitors and proteolysis-targeting chimeras (PROTACs). Researchers frequently search for "boronic acid applications in cancer therapy" or "Suzuki coupling reagents 2024," reflecting the compound's relevance in cutting-edge science. The 2-cyano-5-methylphenyl moiety further enhances its utility by improving solubility and binding affinity in biological systems.

From a synthetic chemistry perspective, CAS 1375109-00-4 exhibits exceptional stability under ambient conditions, a critical feature for industrial-scale applications. Analytical techniques such as HPLC and NMR spectroscopy confirm its high purity (>98%), meeting stringent requirements for GMP-compliant production. The compound's molecular weight (175.0 g/mol) and logP value (1.8) make it particularly suitable for medicinal chemistry projects focusing on CNS drug development—a trending topic in pharmaceutical forums.

Environmental considerations have also shaped recent discussions about (2-cyano-5-methylphenyl)boronic acid. With growing interest in "green chemistry alternatives," this compound's low ecotoxicity profile and biodegradability potential position it favorably compared to traditional heavy metal catalysts. Its application in OLED materials and organic semiconductors responds to the booming demand for energy-efficient display technologies—another hot topic in material science circles.

The commercial landscape for 1375109-00-4 reflects these diverse applications. Major suppliers now offer customized bulk quantities with certificates of analysis (CoA), addressing the needs of both academic researchers and industrial manufacturers. Pricing trends show steady demand, particularly from regions with strong biotech infrastructure like North America and Asia-Pacific. For laboratories seeking "high-purity boronic acids" or "reliable cross-coupling partners," this compound represents a strategic investment in future-ready chemistry.

Quality control protocols for (2-cyano-5-methylphenyl)boronic acid have evolved significantly, with advanced LC-MS methods now capable of detecting impurities at ppm levels. This aligns with regulatory emphasis on ICH guidelines for pharmaceutical intermediates. Storage recommendations typically suggest argon-protected environments at 2-8°C to maintain optimal stability—a practical consideration frequently searched by laboratory managers.

Looking ahead, the scientific community anticipates expanded applications of CAS 1375109-00-4 in bioconjugation chemistry and diagnostic probe development. Emerging research explores its potential in fluorescent sensors for biomarker detection, tapping into the growing point-of-care diagnostics market. These developments underscore the compound's versatility beyond traditional synthetic roles, offering researchers multiple avenues for innovation.

Recommended suppliers
Nanjing Jubai Biopharm
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nanjing Jubai Biopharm
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hangzhou Cedareal Technology Co., Ltd.
上海帛亦醫(yī)藥科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Shanghai Jinhuan Chemical CO., LTD.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Jinhuan Chemical CO., LTD.