3-Bromo-1H-pyrazol-5-amine

Basic Information

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CAS Number

950739-21-6

Molecular Formula

C3H4BrN3

Molecular Weight

161.99 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

Agricultural Chemicals Pesticides Herbicides

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

SMILES

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C1=C(NN=C1N)Br

InChI

InChI=1S/C3H4BrN3/c4-2-1-3(5)7-6-2/h1H,(H3,5,6,7)

InChIKey

VGBYIGUWAWHQOT-UHFFFAOYSA-N

LogP

0.7544000000000002

Topological Polar Surface Area

54.7 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

67.2

Safety Information

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Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

H311 Toxic in contact with skin
Acute toxicity, dermal

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H331 Toxic if inhaled
Acute toxicity, inhalation

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

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

5-Bromo-1H-pyrazol-3-amine
3-Bromo-1H-pyrazol-5-amine
3-Amino-5-bromopyrazole
3-Bromo-5-amine-1H-pyrazol
5-amino-3-bromo-1h-pyrazole
5-bromo-1H-pyrazole-3-amine
VGBYIGUWAWHQOT-UHFFFAOYSA-N
RW3294
FCH995956
STL557206
BBL103396
SB12057
SY027745
AM807168
AX8212887
AB0051975
W9724
ST240
5-Bromo-1H-pyrazol-3-amine (ACI)
5-bromo-1H-pyrazol-3-amine
GS-3976
DB-315226
SCHEMBL17627068
AKOS015919769
1203705-55-8
DTXSID70673028
CS-B0747
5-Bromo-1H-pyrazol-3-amine,3-Bromo-1H-pyrazol-5-amine
MFCD22199259
3-Bromo-5-amino-1h-pyrazole
EN300-121441

MDL Number

MFCD22199259

FAQ

What regulatory guidelines apply to 3-Bromo-1H-pyrazol-5-amine (CAS: 950739-21-6)?

3-Bromo-1H-pyrazol-5-amine (CAS: 950739-21-6) is subject to various regulatory guidelines. It falls under the scope of the Global Harmonized System (GHS) for classification and labeling of chemicals, which includes specific hazard categories such as skin and eye irritation. Additionally, it is regulated under the REACH (Registration, Evaluation, Authorization and Restriction of Chemicals) regulations in the EU, requiring manufacturers and importers to register substances with the European Chemicals Agency (ECHA). In the USA, it is managed by the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) for environmental and health safety, respectively.

Are there alternatives to 3-Bromo-1H-pyrazol-5-amine (CAS: 950739-21-6) in synthesis?

Several alternatives to 3-Bromo-1H-pyrazol-5-amine (CAS: 950739-21-6) are available in synthesis, such as 3-chloro-1H-pyrazol-5-amine and 5-bromo-1H-pyrazol-3-amine. These analogs can serve similar functional roles in chemical reactions. In addition, researchers might consider using isomers or related amine derivatives with different functional groups, which can offer similar reactivity profiles with varying physical and chemical properties, depending on the specific application.

What is the market or research trend for 3-Bromo-1H-pyrazol-5-amine (CAS: 950739-21-6)?

The market for 3-Bromo-1H-pyrazol-5-amine (CAS: 950739-21-6) is growing in research and development, particularly in the fields of medicinal chemistry and materials science. Its unique chemical structure makes it a valuable compound for synthesizing bioactive molecules and developing novel materials. Recent trends suggest increased interest in its use as an intermediate for drug synthesis and as a component in advanced materials, such as electronic and optical materials. Market demand is also influenced by ongoing research into its potential applications in pharmaceuticals and agrochemicals.

How should waste containing 3-Bromo-1H-pyrazol-5-amine (CAS: 950739-21-6) be handled?

Waste containing 3-Bromo-1H-pyrazol-5-amine (CAS: 950739-21-6) should be handled according to the appropriate disposal methods as outlined by environmental regulations. Collection of waste liquids should be done in appropriate containers, and neutralization of any acidic or basic waste should be performed to minimize environmental impact. For solid waste, it is advisable to incinerate or dispose of it at a professional waste disposal facility. Proper labeling and documentation of the waste are crucial, and any handling should be conducted in accordance with safety protocols to prevent environmental contamination and ensure worker safety.