5-Bromo-7H-pyrrolo[2,3-d]pyrimidine

Basic Information

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CAS Number

175791-49-8

Molecular Formula

C6H4BrN3

Molecular Weight

198.02 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Density

1.895

Refractive Index

1.746

SMILES

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C1=C(C2=CN=CN=C2N1)Br

InChI

InChI=1S/C6H4BrN3/c7-5-2-9-6-4(5)1-8-3-10-6/h1-3H,(H,8,9,10)

InChIKey

CMXNUWNEWCACQH-UHFFFAOYSA-N

LogP

1.7203999999999995

Topological Polar Surface Area

41.57 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

130

Synonyms & References

English

SCHEMBL18341916
FS-2779
FT-0646957
AMY7021
DTXSID80445011
CS-W019834
SY006993
J-517142
5-bromo-7H-pyrrolo[2,3-d]pyrimidine
MFCD01877574
7H-Pyrrolo[2,3-d]pyrimidine, 5-bromo-
SCHEMBL1085884
AKOS006276861
CMXNUWNEWCACQH-UHFFFAOYSA-N
175791-49-8
EN300-104570
A812116
PB29169
7H-Pyrrolo[2,3-d]pyrimidine,5-bromo-
5-Bromo-7H-pyrrolo[2,3-d]...
5-Bromopyrrolo<2,3-d>pyrimidine
1H-Pyrrolo[2,3-d]pyrimidine, 5-bromo-
5-broMo-7H-pyrrolo[2
PubChem14723
5-bromopyrrolopyrimidine
FCH845146
RP25482
RP25581
EN002877
BC003923
7H-Pyrrolo[2,3-d]pyrimidine

MDL Number

MFCD01877574

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine (CAS: 175791-49-8)?

5-Bromo-7H-pyrrolo[2,3-d]pyrimidine (CAS: 175791-49-8) must adhere to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for hazardous communication. In the European Union, it also falls under the Registration, Evaluation, Authorization, and Restriction of Chemicals (REACH) regulation. Additionally, it may be subject to FDA and EPA regulations in the United States, particularly for pharmaceutical and environmental safety concerns.

Are there alternatives to 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine (CAS: 175791-49-8) in synthesis?

Several alternatives to 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine (CAS: 175791-49-8) exist in synthesis, including 5-iodo-7H-pyrrolo[2,3-d]pyrimidine and 5-chloro-7H-pyrrolo[2,3-d]pyrimidine, which may serve similar functional roles in various reactions depending on the desired outcome and reactivity profile.

What is the market or research trend for 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine (CAS: 175791-49-8)?

The market for 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine (CAS: 175791-49-8) shows increasing demand due to its applications in pharmaceuticals and agrochemicals. Research trends focus on its use as an intermediate in drug discovery and development, particularly in anti-infective and antiviral agents. Additionally, the compound is explored in agricultural research for its potential as a herbicide.

How should waste containing 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine (CAS: 175791-49-8) be handled?

Waste containing 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine (CAS: 175791-49-8) should be collected in appropriate containers, labeled with the chemical name and hazard information. The waste should then be treated through incineration or professional waste disposal services. Environmental precautions include ensuring that the waste does not contaminate soil or water, and following local and national waste management regulations.