5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole

Basic Information

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CAS Number

73963-42-5

Molecular Formula

C11H19ClN4

Molecular Weight

242.75 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

50.0 to 54.0 deg-C

Boiling Point

425.2°C at 760 mmHg

Density

1.3

Flash Point

210.9±22.9 °C

Refractive Index

1.622

SMILES

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C1CCC(CC1)N2C(=NN=N2)CCCCCl

InChI

InChI=1S/C11H19ClN4/c12-9-5-4-8-11-13-14-15-16(11)10-6-2-1-3-7-10/h10H,1-9H2

InChIKey

INTQSGGUSUSCTJ-UHFFFAOYSA-N

LogP

2.7398000000000007

Topological Polar Surface Area

43.6 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

196

Safety Information

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Hazard Statement

H228 Flammable solid
Flammable solids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 4.1 Class 4.1

Synonyms & References

English

5-(4-Chlorobutyl)-1-Cyclohexanyltetrazole
AKOS015850585
CS-0210299
C2013
AM90306
D87626
AS-12402
5-(4-CHLOROBUTYL)-1-CYCLOHEXANYL TETRAZOLE
1H-Tetrazole, 5-(4-chlorobutyl)-1-cyclohexyl-; 5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole; 1-Cyclohexyl-5-(4-chlorobutyl)-1,2,3,4-tetrazole; 1-Cyclohexyl-5-(4-chlorobutyl)tetrazole
5-(4-Chlorobutyl)-1-Cyclohexyl-1H-Tetrazole
1-cyclohexyl-5-(4-chlorobutyl)tetrazole
MFCD01076191
DTXSID20459132
5-(4-chlorobutyl)-1-cyclohexyltetrazole
5-(4chlorobutyl)-1-cyclohexyl-1H-tetrazole
NS00009334
FT-0664587
EC 616-036-0
1-cyclohexyl-5-(4-chlorobutyl) tetrazole
5-(4-Chlorobuty)-1-cyclohexyl tetrazole
5-(4-chlorobutyl)-1-cyclohexyl-1H-1,2,3,4-tetrazole
5-(4-Chlorobuty)-1-Cyclohexyl Tetrazol
AMY13545
1H-Tetrazole, 5-(4-chlorobutyl)-1-cyclohexyl-
C11H19ClN4
AC-4335
A837981
5-(4-Chlorobuty)-1-Cyclohexyl;6-HYDROXY-3 pound not4-DIHYDROQUINOLONE
SCHEMBL1031402
73963-42-5
1-Cyclohexyl-5-(4-chlorobutyl)-1H-tetrazole

MDL Number

MFCD01076191

Customs Code

2933990090

FAQ

What is 5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole ( CAS: 73963-42-5 )?

5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole ( CAS: 73963-42-5 ) is a synthetic organic compound containing a tetrazole ring and functional substituents. It is typically a white crystalline solid with low solubility in water but moderate solubility in organic solvents. Its structure includes a cyclohexyl group and a 4-chlorobutyl side chain, making it relevant in pharmaceutical and chemical research applications.

What are the main uses of 5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole ( CAS: 73963-42-5 )?

5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole ( CAS: 73963-42-5 ) is primarily used as a pharmaceutical intermediate in the development of drug candidates targeting metabolic disorders. Its tetrazole moiety is valuable in creating bioactive molecules, while its structural versatility makes it applicable in agrochemicals, materials science, and research for novel chemical syntheses.

Is 5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole ( CAS: 73963-42-5 ) safe?

5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole ( CAS: 73963-42-5 ) requires careful handling due to potential toxicity. It is classified as a hazardous chemical under REACH regulations, necessitating protective measures like gloves, goggles, and ventilation. Safety data sheets (SDS) recommend avoiding inhalation and skin contact, and proper disposal methods should be followed to ensure compliance with environmental and health standards.

How should 5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole ( CAS: 73963-42-5 ) be stored?

5-(4-Chlorobutyl)-1-cyclohexyl-1H-tetrazole ( CAS: 73963-42-5 ) should be stored in a cool, dry place away from light. Maintain storage conditions at 2-8°C to ensure stability, and keep it in a sealed, airtight container to prevent moisture ingress. Avoid exposure to incompatible substances and store in a well-ventilated area to maintain chemical integrity and safety.