1-(5-Bromoquinoxalin-6-yl)thiourea

Basic Information

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CAS Number

842138-74-3

Molecular Formula

C9H7BrN4S

Molecular Weight

283.15 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

198-202ºC

Boiling Point

435.4°C at 760 mmHg

Density

1.835

SMILES

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NC(=S)Nc1ccc2c(c1Br)nccn2

InChI

1S/C9H7BrN4S/c10-8-5-3-12-4-13-6(5)1-2-7(8)14-9(11)15/h1-4H,(H3,11,14,15)

InChIKey

HURGDIYVXQDVMD-UHFFFAOYSA-N

LogP

2.0477999999999996

Topological Polar Surface Area

63.83 Å²

Hydrogen Bond Donor/Acceptor

3 / 4

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

5-Bromoquinazolin-6-ylthiourea
N-(5-Bromoquinoxalin-6-yl)thiourea
1-(5-Bromoquinoxalin-6-yl)thiourea
Thiourea, N-(5-bromo-6-quinoxalinyl)
(5-BroMo-6-quinoxalinyl)thiourea
5-Bromoquinaxolin-6-ylthiourea
N-(5-bromo-6-quinoxalinyl)thioure
N-(5-BroMo-6-quinoxalinyl)thiourea
1-(5-bromoquinoxalin-6-yl)thiourea

MDL Number

MFCD08445609

Customs Code

2933990090

FAQ

What is 1-(5-Bromoquinoxalin-6-yl)thiourea (CAS: 842138-74-3)?

1-(5-Bromoquinoxalin-6-yl)thiourea is an organic compound with the CAS number 842138-74-3. It has a molecular formula of C14H10BrN4S. This compound is a derivative of quinoxaline with a thiourea group attached to the 6-position, making it useful in various chemical and pharmaceutical applications.

What are the main uses of 1-(5-Bromoquinoxalin-6-yl)thiourea (CAS: 842138-74-3)?

1-(5-Bromoquinoxalin-6-yl)thiourea (CAS: 842138-74-3) is primarily used in pharmaceutical research for developing new anti-inflammatory and antiproliferative agents. It also has potential applications in the synthesis of other heterocyclic compounds and as a precursor in organic synthesis.

Is 1-(5-Bromoquinoxalin-6-yl)thiourea (CAS: 842138-74-3) safe?

1-(5-Bromoquinoxalin-6-yl)thiourea (CAS: 842138-74-3) is generally considered safe under controlled laboratory conditions. However, it should be handled with care due to its chemical nature. Protective gloves, goggles, and appropriate laboratory attire are recommended. Ingestion or inhalation should be avoided, and skin contact should be minimized.

How should 1-(5-Bromoquinoxalin-6-yl)thiourea (CAS: 842138-74-3) be stored?

1-(5-Bromoquinoxalin-6-yl)thiourea (CAS: 842138-74-3) should be stored in a cool, dry place away from direct sunlight and moisture. It is best kept in a tightly sealed container to prevent degradation. Storage temperature should not exceed 25°C. Avoid contact with incompatible materials such as acids or strong oxidizing agents.