347949

3-Cyanoindole

98%

• 동의어(들): 3-Indolecarbonitrile, NSC 24935
• 실험식(Hill 표기법): C₉H₆N₂
• CAS Number: 5457-28-3
• Molecular Weight: 142.16
• MDL number: MFCD00022717
• UNSPSC 코드: 12352100
• PubChem Substance ID: 24861537

속성

• 분석: 98%
• mp: 179-182 °C (lit.)
• SMILES string: N#Cc1c[nH]c2ccccc12
• InChI: 1S/C9H6N2/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H
• InChI key: CHIFTAQVXHNVRW-UHFFFAOYSA-N

설명

일반 설명

3-Cyanoindole undergoes regiospecific bromination to afford 6-bromo-3-cyanoindole.[1] 3-Cyanoindole is formed during the flash vacuum thermolysis (FVT) of 3-azidoquinoline.[2]

애플리케이션

Reactant for preparation of:

• Tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators
• Inhibitors of the C-terminal domain of RNA polymerase II with antitumor activities
• 4-substituted β-lactams
• Biologically active Indoles
• Inhibitors of glycogen synthase kinase 3β (GSK-3)
• HIV-1 integrase inhibitors
• Indole fragments as inosine monophosphate dehydrogenase (IMPDH) inhibitors
• Aziridinomitosene skeleton
• Potential antiviral agents

Reactant for:

• Intramolecular oxidative C-H coupling reactions with applications in medium-ring synthesis techniques

안전성 정보

• 픽토그램: GHS07
• 신호어: Warning
• 유해 및 위험 성명서: H302 + H312 + H332,H315,H319,H335
• 예방조치 성명서: P261 - P280 - P301 + P312 - P302 + P352 + P312 - P304 + P340 + P312 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - 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