5-{[2-(2-Butoxyethoxy)ethoxy]methyl}-6-propyl-1,3-benzodioxole

Basic Information

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CAS Number

51-03-6

Molecular Formula

C19H30O5

Molecular Weight

338.44 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

No data available

Boiling Point

180 °C

Water Solubility

<0.1 g/100="" ml="" at="" 18℃=""></0.1>

Flash Point

>230?°F

Solubility

water: slightly soluble0.0289g/L at 20.4°C

Refractive Index

n20/D 1.498(lit.)

Vapor Pressure

1.16E-10mmHg at 25°C

SMILES

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CCCCOCCOCCOCc1cc2OCOc2cc1CCC

InChI

InChI=1S/C19H30O5/c1-3-5-7-20-8-9-21-10-11-22-14-17-13-19-18(23-15-24-19)12-16(17)6-4-2/h12-13H,3-11,14-15H2,1-2H3

InChIKey

FIPWRIJSWJWJAI-UHFFFAOYSA-N

LogP

3.7177000000000024

Topological Polar Surface Area

46.150000000000006 Å²

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

312

Safety Information

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GHS Hazard Pictograms

H331

H410

Hazard Statement

H331 Toxic if inhaled
Acute toxicity, inhalation

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

Hazard Class

Class 6.1(b) Class 6.1(b)

Stability

Stable. Combustible. Incompatible with oxidizing agents.

Toxicity

LD50 orally in female, male rats: 6150, 7500 mg/kg (Gaines)

Synonyms & References

English

5-((2-(2-Butoxyethoxy)ethoxy)methyl)-6-propylbenzo[d][1,3]dioxole
2-(2-butoxyethoxy)ethyl 6-propylpiperonyl ether
Piperonylbutoxide
PBO
3,4-Methylenedioxy-6-Propylbenzyl-n-Butyldiethyleneglycolether
Piperonyl butoxide (PBO)
Diperonyl butoxide
ENT-14250
Xylose Lysine Desoxycholate Agar Medium
2-(2-Butoxyethoxy)ethyl (6-propylpiperonyl) ether
5-[[2-(2-butoxyethoxy)ethoxy]methyl]-6-propyl-1,3-benzodioxole
5-[2-(2-butoxyethoxy)ethoxymethyl]-6-propyl-1,3-benzodioxole
5-{[2-(2-butoxyethoxy)ethoxy]methyl}-6-propyl-2H-1,3-benzodioxole
Butacid
BUTACIDE
Butocide
INCITE
nia5273
Pip
PRENTOX
Pyrenon
Vex
4,5-Methylenedioxy-2-propylbenzyldiethyleneglycol butyl ether
增效醚
Piperonyl butoxide
5-((2-(2-butoxyethoxy)ethoxy)methyl)-6-propylbenzo[d][1,3]dioxole

MDL Number

MFCD00005842

Customs Code

29329990

FAQ

What is 5-{[2-(2-Butoxyethoxy)ethoxy]methyl}-6-propyl-1,3-benzodioxole (CAS: 51-03-6)?

5-{[2-(2-Butoxyethoxy)ethoxy]methyl}-6-propyl-1,3-benzodioxole (CAS: 51-03-6) is an organic compound containing a benzodioxole ring with substituents at positions 5 and 6. It features a complex ethoxy and butoxy group chain, contributing to its solubility and reactivity in chemical processes. This compound is primarily used as an intermediate in pharmaceutical and industrial applications.

What are the main uses of 5-{[2-(2-Butoxyethoxy)ethoxy]methyl}-6-propyl-1,3-benzodioxole (CAS: 51-03-6)?

5-{[2-(2-Butoxyethoxy)ethoxy]methyl}-6-propyl-1,3-benzodioxole (CAS: 51-03-6) is mainly used in pharmaceutical research for drug development, as a solvent in organic synthesis, and in the production of specialty chemicals. Its unique structure makes it valuable for creating compounds with specific biological activities or functional properties.

Is 5-{[2-(2-Butoxyethoxy)ethoxy]methyl}-6-propyl-1,3-benzodioxole (CAS: 51-03-6) safe?

5-{[2-(2-Butoxyethoxy)ethoxy]methyl}-6-propyl-1,3-benzodioxole (CAS: 51-03-6) is generally considered safe when handled properly. However, it requires standard laboratory precautions, including use of gloves and ventilation, due to its potential irritancy. Always follow safety data sheet guidelines for exposure and disposal.

How should 5-{[2-(2-Butoxyethoxy)ethoxy]methyl}-6-propyl-1,3-benzodioxole (CAS: 51-03-6) be stored?

Store 5-{[2-(2-Butoxyethoxy)ethoxy]methyl}-6-propyl-1,3-benzodioxole (CAS: 51-03-6) in a cool, dry place away from light. Keep in a sealed container to prevent moisture absorption and maintain stability. Avoid extreme temperatures and ensure proper ventilation to preserve chemical integrity.