Ethyl (phenylsulfonyl)acetate

Basic Information

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CAS Number

7605-30-3

Molecular Formula

C10H12O4S

Molecular Weight

228.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

43.0 to 46.0 deg-C

SMILES

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CCOC(=O)CS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C10H12O4S/c1-2-14-10(11)8-15(12,13)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3

InChIKey

NJBWORPRIRNTLH-UHFFFAOYSA-N

LogP

1.0234

Topological Polar Surface Area

60.440000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

296

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

SMR000126304
FT-0636534
Ethyl (phenylsulphonyl)acetate
NS00037753
NCGC00246575-01
ETHYL2-AMINO-5-PHENYL-4-THIAZOLECARBOXYLATE
HMS2338D12
DTXSID50226950
NJBWORPRIRNTLH-UHFFFAOYSA-N
MFCD00025041
EN300-1600332
AMY24818
ethyl alpha-phenylsulfonylacetate
J-520651
ethyl (phenylsulfonyl)acetate
10X-0939
SCHEMBL2024141
Ethyl (benzenesulphonyl)acetate
ethyl 2-(phenylsulfonyl)acetate
ethyl 2-(benzenesulfonyl)acetate
SY051006
phenyl carbethoxymethyl sulfone
P1306
Ethyl Phenylsulfonylacetate
ethyl benzenesulfonylacetate
7605-30-3
A9652
Phenylsulfonylacetic Acid Ethyl Ester
AKOS005076797
CS-0151564
CHEMBL1585295

MDL Number

MFCD00025041

Customs Code

2916399090

FAQ

What regulatory guidelines apply to Ethyl (phenylsulfonyl)acetate (CAS: 7605-30-3)?

Ethyl (phenylsulfonyl)acetate (CAS: 7605-30-3) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which includes health, environmental, and physical hazard classifications. In Europe, it falls under REACH regulations, requiring registration and notification to authorities. For food and pharmaceutical applications, it may be subject to FDA and EPA regulations concerning safety, purity, and labeling requirements.

Are there alternatives to Ethyl (phenylsulfonyl)acetate (CAS: 7605-30-3) in synthesis?

Alternatives to Ethyl (phenylsulfonyl)acetate (CAS: 7605-30-3) in synthesis include related sulfonates or acetates, such as methyl phenylsulfonyl acetate or other functionalized acetates. These can serve similar roles in organic synthesis depending on the specific reaction conditions and desired outcome.

What is the market or research trend for Ethyl (phenylsulfonyl)acetate (CAS: 7605-30-3)?

The market for Ethyl (phenylsulfonyl)acetate (CAS: 7605-30-3) is growing due to its use in fragrance and flavor industries. Research trends focus on its potential in pharmaceuticals and as an intermediate in synthetic chemistry. However, the market remains niche, with steady demand driven by regulatory compliance and safety considerations.

How should waste containing Ethyl (phenylsulfonyl)acetate (CAS: 7605-30-3) be handled?

Waste containing Ethyl (phenylsulfonyl)acetate (CAS: 7605-30-3) should be collected in sealed, labeled containers and disposed of through professional waste management services. Proper incineration is recommended, with adherence to local environmental regulations. Precautions include ensuring the waste is properly decontaminated to prevent environmental hazards and ensure worker safety.