Phenyl(sulfo)acetic acid

Basic Information

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CAS Number

41360-32-1

Molecular Formula

C8H8O5S

Molecular Weight

216.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

98-102°C

SMILES

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C1=CC=C(C=C1)C(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C8H8O5S/c9-8(10)7(14(11,12)13)6-4-2-1-3-5-6/h1-5,7H,(H,9,10)(H,11,12,13)

InChIKey

USNMCXDGQQVYSW-UHFFFAOYSA-N

LogP

0.7001000000000001

Topological Polar Surface Area

91.67 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

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

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

Synonyms & References

English

AKOS005203095
Alpha-PhenylsulfoaceticAcid
D-Sulfophenylacetic acid
BDBM14677
PHENYL(SULFO)ACETIC ACID
AS-16021
39925-38-7
DTXSID30328744
Benzeneacetic acid, a-sulfo-
Epitope ID:120380
alpha-sulphophenylacetic acid
AMY40291
CS-0156541
Q27225710
CHEBI:225282
MFCD09952336
41360-32-1
D78308
SCHEMBL11166146
S-9630
EN300-213272
CHEMBL80333
alpha-Sulfophenylacetic acid
2-sulfo-2-phenylacetic acid
2-Phenyl-2-sulfoaceticacid
USNMCXDGQQVYSW-UHFFFAOYSA-N
2-phenyl-2-sulfoacetic acid
D-Sulfophenylaceticacid
AC-23373
FT-0655001
SY317447

MDL Number

MFCD09952336

Customs Code

2916399090

FAQ

What is Phenyl(sulfo)acetic acid (CAS: 41360-32-1)?

Phenyl(sulfo)acetic acid (CAS: 41360-32-1) is a chemical compound with the molecular formula C8H7NO3S. It is a white solid with a pungent odor. This compound is characterized by its acidic nature and is commonly used in pharmaceuticals and research due to its sulfonic acid group, which enhances its reactivity and solubility.

What are the main uses of Phenyl(sulfo)acetic acid (CAS: 41360-32-1)?

Phenyl(sulfo)acetic acid (CAS: 41360-32-1) finds applications in pharmaceuticals for the synthesis of various drugs and as an intermediate in the production of other chemicals. It is also used in research for its reactivity and in analytical chemistry due to its acidic properties.

Is Phenyl(sulfo)acetic acid (CAS: 41360-32-1) safe?

Phenyl(sulfo)acetic acid (CAS: 41360-32-1) is generally safe when handled with appropriate precautions. It is important to wear protective gear such as gloves and goggles during handling. Keep the compound away from heat and sparks to prevent potential fires. Ensure proper ventilation and avoid inhalation of the dust or fumes.

How should Phenyl(sulfo)acetic acid (CAS: 41360-32-1) be stored?

Phenyl(sulfo)acetic acid (CAS: 41360-32-1) should be stored in a cool, dry place away from direct sunlight and heat sources. Store it in a sealed container to prevent moisture and contamination. The container should be tightly sealed to maintain the purity of the compound.