분석
98%
양식
liquid
refractive index
n20/D 1.607 (lit.)
bp
123-125 °C/8 mmHg (lit.)
density
1.387 g/mL at 25 °C (lit.)
저장 온도
2-8°C
SMILES string
CC(=O)n1ccc2ccccc12
InChI
1S/C10H9NO/c1-8(12)11-7-6-9-4-2-3-5-10(9)11/h2-7H,1H3
InChI key
UUCUQJHYUPXDHN-UHFFFAOYSA-N
관련 카테고리
일반 설명
Quantum chemical calculations of ground state energy, geometrical structure and vibrational wavenumbers of 1-acetylindole has been carried out using density functional (DFT/B3LYP) method. Regioselective acylations of 1-acetylindole (N-acetylindole) under Friedel-Crafts reaction has been reported. Reaction of 1-acetylindole with manganese(III) acetate in the presence of malonic acid, is reported to afford 4-acetyl-3,3a,4,8b-tetrahydro-2H-furo[3,2-b]indol-2-one.
애플리케이션
1-Acetylindole may be used in the stereocontrolled synthesis of (±)-geissoschizine. It may be used in the preparation of (1-acetyl-κO-indolyl-κC2)tetracarbonylmanganese, via a standard cyclomanganation procedure.
Reactant for preparation of:
Reactant for:
- Antimycobacterial agents
- Cyclin-dependent kinase (CDK2) inhibitors
Reactant for:
- C3-C3 oxidative cross-coupling reactions
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point (°F)
Not applicable
Flash Point (°C)
Not applicable
개인 보호 장비
Eyeshields, Gloves
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