157163

3-Cyanobenzoic acid

98%

• 동의어(들): Isophthalic acid mononitrile
• Linear Formula: NCC₆H₄CO₂H
• CAS Number: 1877-72-1
• Molecular Weight: 147.13
• Beilstein: 1862566
• EC Number: 217-511-1
• MDL number: MFCD00002486
• UNSPSC 코드: 12352100
• PubChem Substance ID: 24849661
• NACRES: NA.22

속성

• Quality Level: 100
• 분석: 98%
• 양식: powder
• mp: 220-224 °C (lit.)
• 작용기: carboxylic acid; nitrile
• SMILES string: OC(=O)c1cccc(c1)C#N
• InChI: 1S/C8H5NO2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,(H,10,11)
• InChI key: GYLKKXHEIIFTJH-UHFFFAOYSA-N

설명

애플리케이션

3-Cyanobenzoic acid was used in the preparation of new Co(II)-doped Zn(II)-tetrazole-benzoate coordination polymers via in situ [2+3] cycloaddition reactions with NaN₃ in the presence of Zn(II) and/or Co(II) salts under hydrothermal conditions. It was also used in the synthesis of three-dimensional coordination polymer, [Mn₃(OH)₂Na₂(3-cnba)₆]_n (3-Hcnba = 3-cyanobenzoic acid).

안전성 정보

• 픽토그램: GHS07
• 신호어: Warning
• 유해 및 위험 성명서: H315,H319,H335
• 예방조치 성명서: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• 표적 기관: Respiratory system
• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point (°F): Not applicable
• Flash Point (°C): Not applicable
• 개인 보호 장비: dust mask type N95 (US), Eyeshields, Gloves