Diethyl [(phenylsulfonyl)methyl]phosphonate

Basic Information

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CAS Number

56069-39-7

Molecular Formula

C11H17O5PS

Molecular Weight

292.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Insecticides

Basic Physical Properties

Melting Point

145-148 ºC

Boiling Point

392.3°C at 760 mmHg

Density

1.248

Flash Point

191.1°C

SMILES

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CCOP(=O)(CS(=O)(=O)C1=CC=CC=C1)OCC

InChI

InChI=1S/C11H17O5PS/c1-3-15-17(12,16-4-2)10-18(13,14)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3

InChIKey

RCSDMTWWPNXXPP-UHFFFAOYSA-N

LogP

2.6839000000000013

Topological Polar Surface Area

69.67 Å²

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

371

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Diethoxyphosphorylmethylsulfonylbenzene
RCSDMTWWPNXXPP-UHFFFAOYSA-N
SCHEMBL1396563
Diethyl ((phenylsulfonyl)methyl)phosphonate
Diethyl((phenylsulfonyl)methyl)phosphonate
MFCD03453041
SY111964
Diethyl [(benzenesulfonyl)methyl]phosphonate
diethyl phenylsulphonylmethylphosphonate
diethyl phenylsulfonylmethylphosphonate
diethyl phenylsulfonylmethanephosphonate
FT-0696695
diethyl (phenylsulfonyl)methylphosphonate
AC-31759
DTXSID40447410
Benzenesulfonylmethyl-phosphonic acid diethyl ester
AS-65293
AKOS005167092
AMY41233
W12806
TQP1090
CS-0108760
diethyl [(phenylsulfonyl)methyl]phosphonate
A855100
56069-39-7
A1-02711
DIETHYL (PHENYLSULFONYL)METHANEPHOSPHONATE
diethyl(phenylsulfonyl)methylphosphonate
Phosphonic acid,P-[(phenylsulfonyl)methyl]-, diethyl ester
diethoxyphosphorylmethylsulfonylbenzene
Diethyl phenylsulfonylmethyl phosphonate

MDL Number

MFCD03453041

FAQ

What regulatory guidelines apply to Diethyl [(phenylsulfonyl)methyl]phosphonate (CAS: 56069-39-7)?

Diethyl [(phenylsulfonyl)methyl]phosphonate (CAS: 56069-39-7) should comply with the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for classification and labelling. It must adhere to REACH regulations for registration, evaluation, authorization, and restriction of chemicals in the EU. In the USA, it must meet FDA and EPA requirements regarding its use and disposal. Specific MSDS (Material Safety Data Sheet) and SDS (Safety Data Sheet) must be prepared and available for workplace use.

Are there alternatives to Diethyl [(phenylsulfonyl)methyl]phosphonate (CAS: 56069-39-7) in synthesis?

There are several alternatives to Diethyl [(phenylsulfonyl)methyl]phosphonate (CAS: 56069-39-7) in synthesis, such as alternative phosphonates or other organosulfur compounds. Common substitutes include diethyl phosphonate or related organophosphorus compounds that can serve similar functions in chemical reactions, depending on the specific application and desired outcomes.

What is the market or research trend for Diethyl [(phenylsulfonyl)methyl]phosphonate (CAS: 56069-39-7)?

The market for Diethyl [(phenylsulfonyl)methyl]phosphonate (CAS: 56069-39-7) remains stable, with increasing research in its use as a precursor in organic synthesis and pharmaceuticals. Recent trends indicate growing interest in its application in medicinal chemistry and as a component in developing new drugs. However, market dynamics are influenced by regulatory changes and the emergence of more environmentally friendly alternatives.

How should waste containing Diethyl [(phenylsulfonyl)methyl]phosphonate (CAS: 56069-39-7) be handled?

Waste containing Diethyl [(phenylsulfonyl)methyl]phosphonate (CAS: 56069-39-7) should be collected in appropriate containers and disposed of according to local hazardous waste regulations. Waste should be incinerated or professionally disposed of to minimize environmental impact. Precautions should be taken to prevent leaks and spills during handling and transport. It is essential to follow MSDS and SDS guidelines for safe waste management.