195928

3-(4-tert-Butylphenoxy)benzaldehyde

98%

• Linear Formula: (CH₃)₃CC₆H₄OC₆H₄CHO
• CAS Number: 69770-23-6
• Molecular Weight: 254.32
• EC Number: 274-109-9
• MDL number: MFCD00003359
• UNSPSC 코드: 12352100
• PubChem Substance ID: 24851725
• NACRES: NA.22

속성

• 분석: 98%
• 양식: solid
• refractive index: n20/D 1.57 (lit.)
• bp: 152 °C/0.4 mmHg (lit.)
• density: 0.984 g/mL at 25 °C (lit.)
• SMILES string: CC(C)(C)c1ccc(Oc2cccc(C=O)c2)cc1
• InChI: 1S/C17H18O2/c1-17(2,3)14-7-9-15(10-8-14)19-16-6-4-5-13(11-16)12-18/h4-12H,1-3H3
• InChI key: YZIHNHLGGMSWAD-UHFFFAOYSA-N

설명

애플리케이션

3-(4-tert-Butylphenoxy)benzaldehyde was used in high-throughput parallel synthesis of library compounds for early drug discovery[1]. It was also used in purification platform developed by ArQule that is based on reverse phase high performance liquid chromatography separation and mass directed fractionation[2].

안전성 정보

• 픽토그램: GHS09
• 신호어: Warning
• 유해 및 위험 성명서: H400
• 예방조치 성명서: P273
• Hazard Classifications: Aquatic Acute 1
• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 3
• Flash Point (°F): Not applicable
• Flash Point (°C): Not applicable
• 개인 보호 장비: Eyeshields, Gloves