5-Chloro-6-[(2-imino-1-pyrrolidinyl)methyl]-2,4(1H,3H)-pyrimidinedione hydrochloride (1:1)

Basic Information

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CAS Number

183204-72-0

Molecular Formula

C9H12Cl2N4O2

Molecular Weight

279.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

SMILES

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C1CC(=N)N(C1)CC2=C(C(=O)NC(=O)N2)Cl.Cl

InChI

InChI=1S/C9H11ClN4O2.ClH/c10-7-5(12-9(16)13-8(7)15)4-14-3-1-2-6(14)11;/h11H,1-4H2,(H2,12,13,15,16);1H

InChIKey

KGHYQYACJRXCAT-UHFFFAOYSA-N

LogP

0.7114699999999998

Topological Polar Surface Area

92.81 Å²

Hydrogen Bond Donor/Acceptor

3 / 6

Complexity

404

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

Tipiracil hydrochloride [USAN]
HY-A0063
s3731
Tipiracil hydrochloride, >=98% (HPLC)
5-Chloro-6-(2-iminopyrrolidin-1-yl)methyl-2,4(1H,3H)-pyrimidinedione Hydrochloride
2,4(1H,3H)-PYRIMIDINEDIONE, 5-CHLORO-6-((2-IMINO-1-PYRROLIDINYL)METHYL)-, HYDROCHLORIDE (1:1)
CS-1637
AC-30634
5-CHLORO-6-(2-IMINO-PYRROLIDIN-1-YL)METHYL-2,4(1H,3H)-PYRIMIDINEDIONE HYDROCHLORIDE
EX-A1393
tipiracil.HCl
5-chloro-6-((2-iminopyrrolidin-1-yl)methyl)pyrimidine-2,4(1H,3H)-dione hydrochloride;Tipiracil HCl
183204-72-0
4H59KLQ0A4
tipiracil monohydrochloride
Tipiracil HCl
SCHEMBL1682924
AMY25415
TIPIRACIL HYDROCHLORIDE [MI]
5-Chloro-6-((2-iminopyrrolidin-1-yl)methyl)pyrimidine-2,4(1H,3H)-dione hydrochloride
TIPIRACIL HYDROCHLORIDE COMPONENT OF LONSURF
5-Chloro-6-((2-iminopyrrolidin-1-yl)methyl)pyrimidine-2,4(1H,3H)-dionehydrochloride
5-Chloro-6-(2-iminopyrrolidin-1-yl)methyl-2,4-(1H,3H)-pyrimidinedione Hydrochloride
CHEBI:90877
D10467
TAS-1-462
Q27162848
AKOS027427002
5-chloro-6-(1-(2-iminopyrrolidinyl)-methyl)uracil hydrochloride
LONSURF COMPONENT TIPIRACIL HYDROCHLORIDE
5-chloro-6-[(2-iminopyrrolidin-1-yl)methyl]-1H-pyrimidine-2,4-dione;hydrochloride

MDL Number

MFCD01571384

FAQ

What regulatory guidelines apply to 5-Chloro-6-[(2-imino-1-pyrrolidinyl)methyl]-2,4(1H,3H)-pyrimidinedione hydrochloride (CAS: 183204-72-0)?

5-Chloro-6-[(2-imino-1-pyrrolidinyl)methyl]-2,4(1H,3H)-pyrimidinedione hydrochloride (CAS: 183204-72-0) falls under the scope of GHS classification, which includes health and environmental hazard categories. For synthesis, REACH regulations require registration of chemicals above one tonne per year. FDA and EPA have specific requirements for the handling and disposal of this compound in the United States, including documentation and reporting of significant releases.

Are there alternatives to 5-Chloro-6-[(2-imino-1-pyrrolidinyl)methyl]-2,4(1H,3H)-pyrimidinedione hydrochloride (CAS: 183204-72-0) in synthesis?

In synthesis, alternatives to 5-Chloro-6-[(2-imino-1-pyrrolidinyl)methyl]-2,4(1H,3H)-pyrimidinedione hydrochloride (CAS: 183204-72-0) may include similar compounds like 5-chloro-2,4-diaminopyrimidine or related 5-chloro-2,4(1H,3H)-pyrimidinediones. Common alternative reagents could be amino acids or specific intermediates used in similar pathways, which may offer similar reactivity profiles.

What is the market or research trend for 5-Chloro-6-[(2-imino-1-pyrrolidinyl)methyl]-2,4(1H,3H)-pyrimidinedione hydrochloride (CAS: 183204-72-0)?

The market for 5-Chloro-6-[(2-imino-1-pyrrolidinyl)methyl]-2,4(1H,3H)-pyrimidinedione hydrochloride (CAS: 183204-72-0) is growing due to its applications in medicinal chemistry and drug discovery. Recent research trends focus on its potential as a drug candidate for various diseases. Market dynamics include increasing demand from pharmaceutical industries and emerging research fields exploring its biological activities.

How should waste containing 5-Chloro-6-[(2-imino-1-pyrrolidinyl)methyl]-2,4(1H,3H)-pyrimidinedione hydrochloride (CAS: 183204-72-0) be handled?

Waste containing 5-Chloro-6-[(2-imino-1-pyrrolidinyl)methyl]-2,4(1H,3H)-pyrimidinedione hydrochloride (CAS: 183204-72-0) should be collected in appropriate containers and stored in a secure location. For disposal, incineration is a common method, and professional waste disposal services should be used. Environmental protection precautions include minimizing the release of the compound into the environment and ensuring all waste is handled in compliance with local regulations.