1-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole

Basic Information

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CAS Number

66246-88-6

Molecular Formula

C13H15Cl2N3

Molecular Weight

284.19 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

Melting Point

56-60°C

Boiling Point

436.06°C (rough estimate)

Density

1.2556 (rough estimate)

Refractive Index

1.6300 (estimate)

Vapor Pressure

0.0±1.0 mmHg at 25°C

SMILES

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CCCC(CN1C=NC=N1)C1=C(Cl)C=C(Cl)C=C1

InChI

InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3

InChIKey

WKBPZYKAUNRMKP-UHFFFAOYSA-N

LogP

4.168800000000004

Topological Polar Surface Area

30.71 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

252

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H410 Very toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Synonyms & References

English

Penconazole
1-[2-(2,4-dichlorophenyl)-n-pentyl]-1h-1,2,4-triazole
1-[2-(2,4-DICHLOROPHENYL)PENTYL]-1,2,4-TRIAZOLE
Penconazol
Penconazole Solution
(RS)-1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole
1-[2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole
onmex
Pine gel
rac-1-[(2R)-2-(2,4-dichlorophenyl)pentyl]-1H-1,2,4-triazole
Topas
topasc
topasmz
topaze
topazec
1-[2-(2,4-Dichlorophenyl)-n-pentyl]-1H-1,2,4-triazole

MDL Number

MFCD00078737

Customs Code

2933990015

FAQ

What is 1-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole (CAS: 66246-88-6)?

1-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole (CAS: 66246-88-6) is an organic compound with a chemical structure that includes a triazole ring and a pentyl chain substituted with a 2,4-dichlorophenyl group. It is used in various applications due to its unique chemical properties.

What are the main uses of 1-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole (CAS: 66246-88-6)?

1-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole is primarily used in pharmaceuticals as an intermediate for synthesizing other compounds. It also has potential applications in agricultural chemicals and as a research tool.

Is 1-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole (CAS: 66246-88-6) safe?

1-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole is generally safe when handled properly. However, it can be toxic if ingested or inhaled, and skin contact may cause irritation. It should be stored under appropriate safety conditions and handled with gloves and in a well-ventilated area.

How should 1-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole (CAS: 66246-88-6) be stored?

1-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container and away from incompatible materials. Proper safety measures, including personal protective equipment, should always be followed.