2-(Chloromethyl)pyrimidine hydrochloride

Basic Information

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CAS Number

936643-80-0

Molecular Formula

C5H6Cl2N2

Molecular Weight

165.02 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

SMILES

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C1=CN=C(N=C1)CCl.Cl

InChI

InChI=1S/C5H5ClN2.ClH/c6-4-5-7-2-1-3-8-5;/h1-3H,4H2;1H

InChIKey

XLGVMJXAZRCTRU-UHFFFAOYSA-N

LogP

1.6371999999999998

Topological Polar Surface Area

25.78 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

61.4

Safety Information

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Hazard Statement

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

2-(chloromethyl)-Pyrimidine (hydrochloride)
2-(CHLOROMETHYL)PYRIMIDINE HCL
2-(ChloroMethyl)pyriMidine hydrochloride
2-Chloromethyl-pyrimidine hydrochloride
AMMD00055
2-(Chloromethyl)pyrimidine, HCl
XLGVMJXAZRCTRU-UHFFFAOYSA-N
BCP22371
2-(chloromethyl)pyrimidine, chloride
SBB087869
CC0062
PB20403
SY018344
Pyrimidine,2-(chloromethyl)-,hydrochloride
ST2409382
ST1140957
AB00277
2-(Chloromethyl)pyrimidine hydrochloride
2-(chloromethyl)pyrimidine hydrochloride
AS-18616
2-(chloromethyl)pyrimidine hydrogen chloride
EN300-139231
CS-B0589
2-(Chloromethyl)pyrimidine HCl
SCHEMBL1313015
AKOS005257830
2-(Chloromethyl)pyrimidine--hydrogen chloride (1/1)
2-(CHLOROMETHYL)PYRIMIDINEHYDROCHLORIDE
J-506328
2-(CHLOROMETHYL)-PYRIMIDINE, MONOHYDROCHLORIDE
936643-80-0

MDL Number

MFCD09834372

Customs Code

2933599090

FAQ

What are the physical and chemical properties of 2-(Chloromethyl)pyrimidine hydrochloride (CAS: 936643-80-0)?

2-(Chloromethyl)pyrimidine hydrochloride is a white crystalline solid with a molecular weight of approximately 235.56 g/mol. It has a solubility in water of 20 g/L at 25°C. The compound is moderately reactive, particularly towards nucleophiles and reducing agents. It is sparingly soluble in common organic solvents like ethanol and acetone.

How is 2-(Chloromethyl)pyrimidine hydrochloride (CAS: 936643-80-0) typically synthesized?

2-(Chloromethyl)pyrimidine hydrochloride can be synthesized via the reaction of 2-chloromethylpyrimidine with hydrochloric acid. The synthesis is typically carried out in anhydrous conditions to avoid hydrolysis. The yield is around 85%, with high selectivity towards the desired product.

What industries use 2-(Chloromethyl)pyrimidine hydrochloride (CAS: 936643-80-0)?

2-(Chloromethyl)pyrimidine hydrochloride is primarily used in the pharmaceutical industry as an intermediate in the synthesis of various drugs. It also finds applications in the polymer industry for preparing certain types of resins and coatings. Additionally, it is used in the development of organic sensors and some semiconductor materials.

What precautions should be taken when handling 2-(Chloromethyl)pyrimidine hydrochloride (CAS: 936643-80-0)?

When handling 2-(Chloromethyl)pyrimidine hydrochloride, appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat is essential. Work should be conducted in a fume hood to minimize exposure. Spills should be cleaned up using appropriate absorbents, and the area should be flushed with water. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal information.