1-(4-Phenoxyphenyl)thiourea

Basic Information

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CAS Number

76839-21-9

Molecular Formula

C13H12N2OS

Molecular Weight

244.32 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

175 °C

SMILES

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C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)N

InChI

InChI=1S/C13H12N2OS/c14-13(17)15-10-6-8-12(9-7-10)16-11-4-2-1-3-5-11/h1-9H,(H3,14,15,17)

InChIKey

SSZWMEWZRURHTK-UHFFFAOYSA-N

LogP

3.134400000000001

Topological Polar Surface Area

47.28 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

246

Safety Information

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Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

MFCD00041185
SSZWMEWZRURHTK-UHFFFAOYSA-N
AKOS005075728
1-(4-Phenoxyphenyl)-2-thiourea
CS-0306665
76839-21-9
1-(4-phenoxyphenyl)thiourea
DTXSID00375124
A838863
1-(4-phenoxyphenyl)2-thiourea
N-(4-Phenoxyphenyl)thiourea, AldrichCPR
SCHEMBL653550
N-(4-phenoxyphenyl)thiourea
EN300-87364
4-phenoxyphenylthiourea
Thiourea, N-(4-phenoxyphenyl)-
10N-001
(4-phenoxyphenyl)thiourea
FT-0619376
amino[(4-phenoxyphenyl)amino]methane-1-thione
4-Phenoxyphenylthiourea

MDL Number

MFCD00041185

Customs Code

2930909090

FAQ

What is 1-(4-Phenoxyphenyl)thiourea (CAS: 76839-21-9)?

1-(4-Phenoxyphenyl)thiourea is an organic compound with the CAS number 76839-21-9. It is a thiourea derivative with the molecular formula C14H12N2O2S. It is a white or off-white crystalline solid with a melting point around 200°C. This compound is known for its ability to form complexes and has been studied for its potential pharmacological applications.

What are the main uses of 1-(4-Phenoxyphenyl)thiourea (CAS: 76839-21-9)?

1-(4-Phenoxyphenyl)thiourea (CAS: 76839-21-9) is primarily used in the pharmaceutical industry for the synthesis of certain drugs. It has also shown potential in research for its ability to form metal complexes and for its biological activity. Additionally, it can be used as a chemical reagent in organic synthesis.

Is 1-(4-Phenoxyphenyl)thiourea (CAS: 76839-21-9) safe?

1-(4-Phenoxyphenyl)thiourea (CAS: 76839-21-9) is generally safe when handled with appropriate precautions. It is important to wear protective gloves, goggles, and laboratory clothing when working with this compound. Avoid contact with skin and eyes, and ensure proper ventilation. Spills should be cleaned up carefully following standard laboratory procedures.

How should 1-(4-Phenoxyphenyl)thiourea (CAS: 76839-21-9) be stored?

1-(4-Phenoxyphenyl)thiourea (CAS: 76839-21-9) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture and light exposure. The storage temperature should be below 25°C. Ensure that the container is clearly labeled and stored in a secure location to prevent accidental exposure or misuse.