ChemicalBook >> CAS DataBase List >>2,4,6-Trichloropyrimidine

2,4,6-Trichloropyrimidine

CAS No.
3764-01-0
Chemical Name:
2,4,6-Trichloropyrimidine
Synonyms
2,4,6-TRICHLOROPYRIDINE;TCPY;TrichloropyriMidine;2,4,6-trichloro-pyrimidin;NSC 6494;AURORA KA-4834;2,4,6-TrichloropyriM;Xamoterol Impurity 3;6-TrichloropyriMidine;2,4,6-TRICHLOROPYRIMIDINE
CBNumber:
CB6466644
Molecular Formula:
C4HCl3N2
Molecular Weight:
183.42
MDL Number:
MFCD00006063
MOL File:
3764-01-0.mol
MSDS File:
SDS
TDS File:
TDS
Last updated:2026-05-28 03:03:16

2,4,6-Trichloropyrimidine Properties

Melting point 23-25 °C (lit.)
Boiling point 210-215 °C (lit.)
Density 1.595 g/mL at 20 °C (lit.)
refractive index n20/D 1.57(lit.)
Flash point >230 °F
storage temp. Keep in dark place,Sealed in dry,Room Temperature
solubility Chloroform, Ethyl Acetate
form Liquid After Melting
pka -7.14±0.30(Predicted)
color Clear colorless to yellow
Water Solubility Insoluble in water.
FreezingPoint 21.0 to 23.0 ℃
BRN 118284
InChI 1S/C4HCl3N2/c5-2-1-3(6)9-4(7)8-2/h1H
InChIKey DPVIABCMTHHTGB-UHFFFAOYSA-N
SMILES Clc1cc(Cl)nc(Cl)n1
CAS DataBase Reference 3764-01-0(CAS DataBase Reference)
FDA UNII ESA3TV26AP
NIST Chemistry Reference Pyrimidine, 2,4,6-trichloro-(3764-01-0)
EPA Substance Registry System Pyrimidine, 2,4,6-trichloro- (3764-01-0)
UNSPSC Code 12352100
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs Respiratory system
PPE Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes  Xn,Xi,T
Risk Statements  20/21/22-36/37/38
Safety Statements  26-36-24/25-23
RIDADR  UN1759
WGK Germany  3
TSCA  TSCA listed
HazardClass  8
PackingGroup  III
HS Code  29335990
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Limited Quantities 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
NFPA 704
1
2 0

2,4,6-Trichloropyrimidine price More Price(70)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich T56200 2,4,6-Trichloropyrimidine 97% 3764-01-0 25g $91.5 2026-04-30 Buy
TCI Chemical T0417 2,4,6-Trichloropyrimidine >98.0%(GC) 3764-01-0 25g $107 2026-04-30 Buy
TCI Chemical T0417 2,4,6-Trichloropyrimidine >98.0%(GC) 3764-01-0 500g $1008 2026-04-30 Buy
TRC TRC-T774180-50G 2,4,6-Trichloropyrimidine 3764-01-0 50g $139 2026-06-03 Buy
TRC TRC-T774180-25G 2,4,6-Trichloropyrimidine 3764-01-0 25g $78 2026-06-03 Buy
Product number Packaging Price Buy
T56200 25g $91.5 Buy
T0417 25g $107 Buy
T0417 500g $1008 Buy
TRC-T774180-50G 50g $139 Buy
TRC-T774180-25G 25g $78 Buy

2,4,6-Trichloropyrimidine Chemical Properties,Uses,Production

Chemical Properties

clear colorless to yellowish liquid after melting

Uses

Fungitoxic substance.

Uses

It is applied In selective Suzuki coupling with arylboronic acids has been reported to give 6-arylpyrimidines.

Synthesis Reference(s)

Journal of the American Chemical Society, 80, p. 5481, 1958 DOI: 10.1021/ja01553a042

Synthesis

Barbituric acid

67-52-7

2,4,6-Trichloropyrimidine

3764-01-0

Example 2: 128.1 g (1 mol) of barbituric acid and 500 ml (5.5 mol) of phosphorus trichloride were sequentially added to a reaction flask, heated to reflux and maintained for 4 hours. Subsequently, 270 ml (3.1 mol) of phosphorus trichloride and 213 g (3 mol) of chlorine were slowly added dropwise to the reaction system, and the reaction solution was kept as a light yellow suspension during the treatment. The amount of chlorine gas should be strictly controlled during the titration process to avoid overdose, and the specific operation was referred to Example 1. After the titration was completed, the reaction was continued to reflux for 1 hour. After completion of the reaction, phosphorus trichloride is removed by distillation. Finally, 2,4,6-trichloropyrimidine was obtained by distillation under pump vacuum according to the method described in Example 1. The yield of the product was 148 g, the yield was 81% of the theoretical value (in terms of barbituric acid), and the absence of 2,4,5,6-tetrachloropyrimidine in the product was confirmed by GC assay.

Toxics Screening Level

The initial threshold screening level (ITSL) for 2,4,6-trichloropyrimidine is 0.1 μg/m3 based on an annual averaging time.

References

[1] Journal of the American Chemical Society, 1980, vol. 102, # 15, p. 5036 - 5044
[2] Patent: US5898073, 1999, A
[3] Patent: US5712394, 1998, A
[4] Polyhedron, 2014, vol. 81, p. 316 - 322
[5] European Journal of Medicinal Chemistry, 2012, vol. 54, p. 159 - 174

67-52-7
3764-01-0
Synthesis of 2,4,6-Trichloropyrimidine from Barbituric acid
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View Lastest Price from 2,4,6-Trichloropyrimidine manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
2,4,6-Trichloropyrimidine pictures 2026-09-02 2,4,6-Trichloropyrimidine
3764-01-0
$3.00-10.00 1KG 99% Henan Fengda Chemical Co., Ltd
2,4,6-Trichloropyrimidine pictures 2025-05-23 2,4,6-Trichloropyrimidine
3764-01-0
$50.00 1kg 99 5000 Hebei Zhuanglai Chemical Trading Co Ltd
2,4,6-Trichloropyrimidine pictures 2025-04-04 2,4,6-Trichloropyrimidine
3764-01-0
1kg 98% 1Ton Henan Aochuang Chemical Co.,Ltd.
2,4,6-trichloro-pyrimidin AURORA KA-4834 2,4,6-TRICHLOROPYRIMIDINE Pyrimidine, 2,4,6-trichloro- 2,4,6-TRICHLOROPYRIDINE 2,3-DIHYDROIMIDAZO 2,1-BBENZO 2,4,6-Trichloropyrimidine, 98.5% 2,4,6-Trichloropyrimidine ,99% 2,4,6-trichloropyridmidine 6-TrichloropyriMidine 2,4,6-TrichloropyriMidine (TPI) NSC 6494 2,4,6-TRICHLOROPYRIMIDINE FOR SYNTHESIS 2,4,6-TrichloropyriM 2 Minus 2 - cheMical pyriMidine 2,4,6-Trichloropyrimidine,98% 2,4,6-Trichloro-1,3-diazine 2,4,6-Trichloropyrimidine > 2,4,6-Trichloropyrimidine (99.5%) Xamoterol Impurity 3 2,4,6-Trichloropyrimidine, 98%min TCPY TrichloropyriMidine 3764-01-0 C4Cl3H1N2 C4HCI3N2 Building Blocks Pyrimidines Halogenated Heterocycles Heterocyclic Building Blocks HETERO CHLORIDE Heterocycle-Pyrimidine series Aromatics Heterocycles Building Blocks Halogenated Heterocycles Heterocyclic Building Blocks Pyrimidines PyrimidinesHeterocyclic Building Blocks Pyridines, Pyrimidines, Purines and Pteredines Organics pharmacetical Pyridine Pyrimidine