4,5,6-Trichloropyrimidine

Basic Information

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CAS Number

1780-27-4

Molecular Formula

C4HCl3N2

Molecular Weight

183.42 g/mol

Basic Physical Properties

Melting Point

51.0 to 55.0 deg-C

Boiling Point

87°C/12mmHg

Density

1.641

Flash Point

137℃

Refractive Index

1.578

SMILES

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C1=NC(=C(C(=N1)Cl)Cl)Cl

InChI

InChI=1S/C4HCl3N2/c5-2-3(6)8-1-9-4(2)7/h1H

InChIKey

AUWPHGWEYHEAIG-UHFFFAOYSA-N

LogP

2.4368

Topological Polar Surface Area

25.78 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

89.8

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

Synonyms & References

English

SCHEMBL83499
DTXSID20290123
NS00120248
NCI60_024048
PS-3884
4,5,6-Trichloropyrimidine
FT-0648452
BCP15609
Pyrimidine, 4,5,6-trichloro-
4,5,6 trichloropyrimidine
EN300-100614
CHEMBL1965328
NSC 66902
AMY11059
Z1201624656
AKOS005259919
NSC-66902
A3953
AC-2411
1780-27-4
AUWPHGWEYHEAIG-UHFFFAOYSA-N
CS-W017036
SY006155
SB57790
T2550
NSC66902
MFCD08458457
4,5,6-Trichlor-pyrimidin
PubChem21473
4,5,6-Trichloro-pyrimidine
KSC497I1P

MDL Number

MFCD08458457

Customs Code

2933599090

FAQ

What is 4,5,6-Trichloropyrimidine (CAS: 1780-27-4)?

4,5,6-Trichloropyrimidine is an organic compound with the chemical formula C4H3Cl3N2. It is a yellow solid with a distinctive odor. This compound is used in various applications such as pesticides and pharmaceuticals.

What are the main uses of 4,5,6-Trichloropyrimidine (CAS: 1780-27-4)?

4,5,6-Trichloropyrimidine is primarily used as an intermediate in the synthesis of pharmaceuticals and as a herbicide. It is also used in research for developing new chemical compounds.

Is 4,5,6-Trichloropyrimidine (CAS: 1780-27-4) safe?

4,5,6-Trichloropyrimidine can be hazardous if not handled properly. It is important to follow safety guidelines such as wearing protective clothing, gloves, and goggles. Storage should be in a cool, dry place away from direct sunlight and heat sources.

How should 4,5,6-Trichloropyrimidine (CAS: 1780-27-4) be stored?

4,5,6-Trichloropyrimidine should be stored in a cool, dry, and well-ventilated area away from direct sunlight and heat sources. It should be kept in a tightly sealed container and away from incompatible materials such as reducing agents.