3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one

Basic Information

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CAS Number

58851-99-3

Molecular Formula

C16H9NO3S

Molecular Weight

295.32 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Melting Point

290-292 °C

Solubility

DMF: soluble

SMILES

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C1=CC=C2C(=C1)N=C(S2)C3=CC4=C(C=C(C=C4)O)OC3=O

InChI

InChI=1S/C16H9NO3S/c18-10-6-5-9-7-11(16(19)20-13(9)8-10)15-17-12-3-1-2-4-14(12)21-15/h1-8,18H

InChIKey

CYONGLVNBSZCQH-UHFFFAOYSA-N

LogP

3.7753000000000005

Topological Polar Surface Area

63.33 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

466

Synonyms & References

English

3-(2-BENZOTHIAZOLYL)UMBELLIFERONE FOR
(3E)-3-(3H-1,3-benzothiazol-2-ylidene)chromene-2,7-dione
3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one
3-(2-benzothiazolyl)-7-hydroxycoumarin
3-(2-benzothioazolyl)-7-hydroxyc
3-(benzo[d]thiazol-2-yl)-7-hydroxy-2H-chromen-2-one
3-(benzothiazol-2yl)-7-hydroxycoumarin
3-benzothiazol-2-yl-7-hydroxychromen-2-one
3-benzothiazol-2-yl-7-hydroxy-chromen-2-one
3-benzothiazol-2-yl-7-hydroxycoumarin
AC1NUBZS
AC1Q797M
CHEBI:490088
CHEMBL437770
ChemDiv3_012345
Coumarin 16
STOCK1S-73976
F0225-0023
SR-01000424247
D85615
NCI60_039100
NoName_1428
DTXSID90902206
3-(2-Benzothiazolyl)umbelliferone
AKOS000276122
BRD-K67053446-001-01-4
SCHEMBL592311
NSC711198
Oprea1_225697
MFCD00037411
SR-01000424247-1

MDL Number

MFCD00037411

FAQ

What regulatory guidelines apply to 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3)?

3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3) falls under the scope of various regulatory guidelines such as REACH for its production and importation in the European Union, and the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) for its transportation. Additionally, the Food and Drug Administration (FDA) and Environmental Protection Agency (EPA) have regulations related to its use in pharmaceuticals and environmental releases, respectively.

Are there alternatives to 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3) in synthesis?

There are several alternatives to 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3) in synthesis, including 3-(1,3-thiazol-2-yl)-7-hydroxy-2H-chromen-2-one and 3-(1,3-imidazol-2-yl)-7-hydroxy-2H-chromen-2-one. These compounds can serve as effective substitutes due to their similar chemical structures and potential for analogous reactions.

What is the market or research trend for 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3)?

The market for 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3) is closely tied to its applications in pharmaceuticals and research, particularly for its use as an intermediate in the synthesis of certain drugs. Research trends are focusing on its potential in medicinal chemistry and its biological activities, with a growing interest in its role as a scaffold for drug discovery.

How should waste containing 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3) be handled?

Waste containing 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3) should be collected in appropriate containers, labeled, and stored in a secure, well-ventilated area. The waste should then be disposed of through incineration or professional waste disposal services that comply with local regulations. Precautions include avoiding contact with skin and inhalation, and adhering to environmental protection guidelines to prevent contamination of soil and water sources.

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Compound Q&A

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Compound Q&A

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3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one | CAS No. 58851-99-3

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Melting Point

Solubility

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Synonyms & References

English

MDL Number

FAQ

What regulatory guidelines apply to 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3)?

Are there alternatives to 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3) in synthesis?

What is the market or research trend for 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3)?

How should waste containing 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-chromen-2-one (CAS: 58851-99-3) be handled?

Related Compounds

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Supplier Information

ShangHaiChengZhu Biotechnology Co Ltd

ShenZhenAiTaHuaXue Co Ltd

Shanghai Aladdin Bio-Technologies Co., Ltd.

Hubei Yangxin Pharmaceutical Technology Co., Ltd.

ShangHaiMaiKeLinShengHuaKeJi Inc

Shanghai Hansi Chemical Co., Ltd.

ABX advanced biochemical compounds GmbH

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