Dibutyl butylphosphonate

Basic Information

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CAS Number

78-46-6

Molecular Formula

C12H27O3P

Molecular Weight

250.31 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Insecticides

Basic Physical Properties

Boiling Point

283 °C

Density

0.946 g/mL at 25 °C

Refractive Index

n20/D 1.432(lit.)

SMILES

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CCCCOP(=O)(CCCC)OCCCC

InChI

InChI=1S/C12H27O3P/c1-4-7-10-14-16(13,12-9-6-3)15-11-8-5-2/h4-12H2,1-3H3

InChIKey

JPGXOMADPRULAC-UHFFFAOYSA-N

LogP

4.613000000000004

Topological Polar Surface Area

35.53 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

181

Synonyms & References

English

78-46-6
Dibutylbutylphosphonate
SCHEMBL575182
NCGC00357031-01
Dibutyl butanephosphonate
DI-N-BUTYL N-BUTYLPHOSPHONATE [HSDB]
C12H27O3P
DTXSID6052536
DIBUTYL BUTYLPHOSPHONATE
dibutyl butyl phosphonate
CAS-78-46-6
dibutylbutylphosphonat-
AKOS015916202
NSC-2666
1-[butoxy(butyl)phosphoryl]oxybutane
2-Chloro-N-(2-hydroxy-pyridin-3-yl)-acetamide
AI3-15018
5GO20BIE6O
Dibutyl butylphosphonate, >=90%
WLN: 4OPO&4&O4
NSC2666
Dibutoxybutylphosphine oxide
LS-106478
butyl-phosphonic acid dibutyl ester
HSDB 2563
Butylphosphonic acid dibutyl
Tox21_303718
Phosphonic acid, P-butyl-, dibutyl ester
4-04-00-03552 (Beilstein Handbook Reference)
BRN 1777999
NSC 2666

MDL Number

MFCD00015244

FAQ

What regulatory guidelines apply to Dibutyl butylphosphonate (CAS: 78-46-6)?

Dibutyl butylphosphonate (CAS: 78-46-6) is regulated under the GHS classification as a flammable liquid. It is also subject to the REACH regulations in the EU, requiring companies to register substances with a threshold of 1 tonne per year. In the USA, it is under EPA and FDA regulations for industrial and consumer use. Proper labeling and safety data sheets (SDS) are essential for handling and storage.

Are there alternatives to Dibutyl butylphosphonate (CAS: 78-46-6) in synthesis?

There are several alternatives to Dibutyl butylphosphonate (CAS: 78-46-6) in synthesis, including other phosphonates like tributyl phosphate (TBP), diethyl butylphosphonate, and various organophosphorus reagents. Each alternative may have different reactivity and stability, so careful selection is required based on the specific synthetic requirements.

What is the market or research trend for Dibutyl butylphosphonate (CAS: 78-46-6)?

The market for Dibutyl butylphosphonate (CAS: 78-46-6) is driven by its use in plasticizers, flame retardants, and as a solvent in various chemical processes. Research trends focus on developing safer and more sustainable alternatives, as well as exploring its potential in new applications such as biomedical and nanotechnology fields. Price trends show a stable market with occasional fluctuations based on supply and demand.

How should waste containing Dibutyl butylphosphonate (CAS: 78-46-6) be handled?

Waste containing Dibutyl butylphosphonate (CAS: 78-46-6) should be collected in appropriate containers labeled with the correct hazardous waste symbols. Incineration is a common disposal method, but professional waste disposal services are recommended due to its flammability. Environmental protection measures include ensuring no spillage and proper handling to prevent contamination of soil and water sources.