Arbidol Impurity 27

Basic Information

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CAS Number

131707-24-9

Molecular Formula

C19H18BrNO3S

Molecular Weight

420.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

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

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

197-201°C

Boiling Point

570.6°C at 760 mmHg

Density

1.44

Flash Point

298.9 ºC

Refractive Index

1.64

SMILES

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CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C)CSC3=CC=CC=C3

InChI

InChI=1S/C19H18BrNO3S/c1-3-24-19(23)18-13-9-17(22)14(20)10-15(13)21(2)16(18)11-25-12-7-5-4-6-8-12/h4-10,22H,3,11H2,1-2H3

InChIKey

DAFNNZWQTJQQAP-UHFFFAOYSA-N

LogP

5.115400000000004

Topological Polar Surface Area

51.46 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

460

Safety Information

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Hazard Statement

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Ethyl 6-bromo-5-hydroxy-1-methyl-2-(phenylthiomethyl)indole-3-carboxylate
Ethyl 6-bromo-5-hydroxy-1-methyl-2-((phenylthio)methyl)-1H-Indole-3-carboxylate
131707-24-9
AKOS001740372
Ethyl 6-bromo-5-hydroxy-1-methyl-2-(phenylsulfanylmethyl)indole-3-carboxylate
BCP10623
SCHEMBL4445035
AS-11470
Indole-3-carboxylic acid, 6-bromo-5-hydroxy-1-methyl-2-(phenylthiomethyl)-, ethyl ester
DTXSID20157186
1H-Indole-3-carboxylic acid, 6-bromo-5-hydroxy-1-methyl-2-[(phenylthio)methyl]-, ethyl ester
SR-01000523199-1
CHEMBL4102199
MFCD00378136
6-bromo-3-ethoxycarbonyl-5-hydroxy-1-methyl-2-phenylthiomethylindole
Oprea1_682742
FT-0682976
ethyl 6-bromo-5-hydroxy-1-methyl-2-phenylthiomethylindole-3-carboxylate
ethyl 6-bromo-5-hydroxy-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
SI 5
1H-Indole-3-carboxylic acid, 6-bromo-5-hydroxy-1-methyl-2-((phenylthio)methyl)-, ethyl ester
D78049
6-bromo-5-hydroxy-1-methyl-2-(phenylthiomethyl)indole-3-carboxylic acid ethyl ester
C19H18BrNO3S
6-Bromo-5-hydroxy-1-methyl-2-[(phenylthio)methyl]-1H-indole-3-carboxylic Acid Ethyl Ester
ethyl 6-bromo-5-hydroxy-1-methyl-2-[(phenylthio)methyl]-1H-indole-3-carboxylate
SR-01000523199
CS-0151811
NIOSH/NL5998090
W-201056
A888383

MDL Number

MFCD00378136

Customs Code

2933990090

FAQ

What is Arbidol Impurity 27 (CAS: 131707-24-9)?

Arbidol Impurity 27 is a by-product found in the synthesis of arbidol, a broad-spectrum antiviral drug. It does not have a distinct chemical formula but is known to contain impurities in the manufacturing process.

What are the main uses of Arbidol Impurity 27 (CAS: 131707-24-9)?

Arbidol Impurity 27 is not used in any commercial or industrial applications. It is primarily of interest in quality control to ensure the purity of arbidol, a drug used for treating influenza and other viral infections.

Is Arbidol Impurity 27 (CAS: 131707-24-9) safe?

Arbidol Impurity 27 is generally considered safe when handled with appropriate precautions. It is important to follow standard safety guidelines and use personal protective equipment (PPE) during handling. It should be kept away from heat, open flames, and oxidizers.

How should Arbidol Impurity 27 (CAS: 131707-24-9) be stored?

Arbidol Impurity 27 should be stored in a cool, dry place away from direct sunlight and heat sources. Sealed containers are recommended to prevent contamination and degradation. Avoid storing it in humid environments to ensure stability.