CAS 576-15-8; 1-acetyl-1h-indol - �뵺�羺�ٷ��ַ

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货号

品牌

产品名称

规格

包装、参考价格

A864441

MACKLIN

1-乙酰吲哚

98%

450元/1g; 1458元/5g; 5386元/25g;

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储存：2-8°C
状态：无色到黄色液体

377104

Sigma-Aldrich

1-Acetylindole

98%

953.72元/1 G; 2852.17元/5 G;

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产品说明

一般描述

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.

应用

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:

Antimycobacterial agents
Cyclin-dependent kinase (CDK2) inhibitors

Reactant for:

C3-C3 oxidative cross-coupling reactions

包装

1, 5 g in glass bottle

其他说明

Tandem Mass Spectrometry data independently generated by Scripps Center for Metabolomics is available to view or download in PDF. 377104.pdf Tested metabolites are featured on Scripps Center for Metabolomics METLIN Metabolite Database. To learn more, visit sigma.com/metlin.

基本信息

经验(实验)分子式	C₁₀H₉NO
分子量	159.18
EC 号	209-396-1
MDL编号	MFCD00038005
PubChem化学物质编号	24863492

产品性质

测定	98%
折射率	n20/D 1.607 (lit.)
bp	123-125 ℃/8 mmHg (lit.)
密度	1.387 g/mL at 25 ℃ (lit.)
储存温度	2-8℃
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

安全信息

储存分类代码	12 - Non Combustible Liquids
WGK	WGK 3
闪点(F)	Not applicable
闪点(C)	Not applicable
个人防护装备	Eyeshields, Gloves

303166

Fluorochem

1-Acetylindole

97%

528元/250mg; 1034元/1g;

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基本信息

CAS Number	576-15-8
MDL Number	MFCD00038005
Density	1.387

安全信息

图形或危害标志
危险性说明	H302: Harmful if swallowed. H315: Causes skin irritation. H319: Causes serious eye irritation. H335: May cause respiratory irritation.
防范说明	P233: Keep container tightly closed. P260: Do not breathe . P261: Avoid breathing P264: Wash hands thoroughly after handling. P270: Do not eat, drink or smoke when using this product. P271: Use only outdoors or in a well-ventilated area. P280: Wear . P301 + P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell. P302 + P352: IF ON SKIN: Wash with plenty of soap and water. P304: IF INHALED: . P304 + P340: IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing. P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P312: Call a POISON CENTER or doctor/physician if you feel unwell. P321: Specific treatment (see . on this label). P330: Rinse mouth. P332 + P313: If skin irritation occurs: Get medical advice/ attention. P337 + P313: If eye irritation persists: Get medical advice/attention. P340: Remove victim to fresh air and keep at rest in a position comfortable for breathing. P362: Take off contaminated clothing and wash before reuse. P403: Store in a well-ventilated place. P403 + P233: Store in a well-ventilated place. Keep container tightly closed. P405: Store locked up. P501: Dispose of contents/container to local regulations.