SU9516 | CAS No. 666837-93-0

SU9516

Basic Information

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CAS Number

666837-93-0

Molecular Formula

C13H11N3O2

Molecular Weight

241.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Solubility

DMSO: ~17 mg/mL

SMILES

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COc1ccc2c(c1)/C(=C/c1c[nH]cn1)/C(=O)N2

InChI

InChI=1S/C13H11N3O2/c1-18-9-2-3-12-10(5-9)11(13(17)16-12)4-8-6-14-7-15-8/h2-7H,1H3,(H,14,15)(H,16,17)/b11-4-

InChIKey

QNUKRWAIZMBVCU-WCIBSUBMSA-N

LogP

1.9109999999999994

Topological Polar Surface Area

67.00999999999999 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

369

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

3-((1H-IMIDAZOL-4-YL)METHYLENE)-5-METHOXYINDOLIN-2-ONE
Su-9516
BCP15862
(3E)-3-(1H-Imidazol-5-ylmethylidene)-5-methoxy-1H-indol-2-one

MDL Number

MFCD17010284

FAQ

What regulatory guidelines apply to SU9516 (CAS: 666837-93-0)?

SU9516 (CAS: 666837-93-0) is subject to the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) for hazardous classification. It also falls under the European Union's REACH regulations for registration, evaluation, authorization, and restriction of chemicals. Additionally, the FDA and EPA may require specific handling and reporting procedures depending on its intended use.

Are there alternatives to SU9516 (CAS: 666837-93-0) in synthesis?

SU9516 (CAS: 666837-93-0) is a specialized compound with unique properties. However, alternative reagents such as similar functional group derivatives or isomers might be used depending on the synthesis requirements. For instance, isomer A or B could serve as viable alternatives in certain reactions.

What is the market or research trend for SU9516 (CAS: 666837-93-0)?

The market for SU9516 (CAS: 666837-93-0) is currently growing due to its applications in pharmaceutical and industrial research. Recent trends show increased interest in its use as a catalyst and for developing novel materials. Research is also focusing on its potential in drug discovery and environmental analytics.

How should waste containing SU9516 (CAS: 666837-93-0) be handled?

Waste containing SU9516 (CAS: 666837-93-0) should be collected in properly labeled containers and stored in a secure, well-ventilated area. Incineration or professional waste disposal services are recommended for safe removal. Ensure compliance with local regulations and environmental protection precautions to prevent contamination.