1,3-Thiazinane-2-carboxylic acid

Basic Information

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CAS Number

78233-48-4

Molecular Formula

C5H9NO2S

Molecular Weight

147.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Boiling Point

352.3°C at 760 mmHg

Density

1.288

Flash Point

166.9°C

Refractive Index

1.544

SMILES

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C1CNC(SC1)C(=O)O

InChI

InChI=1S/C5H9NO2S/c7-5(8)4-6-2-1-3-9-4/h4,6H,1-3H2,(H,7,8)

InChIKey

IESZQYHPXVRLMD-UHFFFAOYSA-N

LogP

0.12359999999999993

Topological Polar Surface Area

49.33 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

118

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

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Synonyms & References

English

C76501
SCHEMBL5293023
1,3-Thiazine-2-carboxylic acid
2H-1,3-Thiazine-2-carboxylic acid, tetrahydro-
A865076
EN300-7422499
CS-0155222
1,3-thiazinane-2-carboxylicacid
78233-48-4
DS-8407
DTXSID20999583
AKOS025117291
beta-Homothiaproline
1,3-thiazinane-2-carboxylic acid
2H-1,3-Thiazine-2-carboxylicacid, tetrahydro-
2H-1,3-Thiazine-2-carboxylicacid,tetrahydro-(9CI)
1,3-Thiazinane-2-carboxylic acid
AK164034
FCH3153392
AX8273092
ST24036822

MDL Number

MFCD18814193

FAQ

What is 1,3-Thiazinane-2-carboxylic acid (CAS: 78233-48-4)?

1,3-Thiazinane-2-carboxylic acid (CAS: 78233-48-4) is a heterocyclic organic compound with a sulfur-containing ring. It is a white solid at room temperature and soluble in water. This compound is used in various applications including pharmaceuticals, as a reagent in organic synthesis, and as an intermediate in the production of other chemical compounds.

What are the main uses of 1,3-Thiazinane-2-carboxylic acid (CAS: 78233-48-4)?

1,3-Thiazinane-2-carboxylic acid (CAS: 78233-48-4) is primarily used in the pharmaceutical industry as a precursor for drug synthesis. It is also utilized in organic synthesis as a versatile reagent and in the food industry for certain chemical preparations. Additionally, it serves as a research tool in various chemical and biological studies.

Is 1,3-Thiazinane-2-carboxylic acid (CAS: 78233-48-4) safe?

1,3-Thiazinane-2-carboxylic acid (CAS: 78233-48-4) is generally considered safe when handled with proper precautions. It is important to avoid inhalation, ingestion, or contact with the eyes and skin. Protective equipment such as gloves, goggles, and a laboratory coat should be worn during handling. Storage in a cool, dry place away from direct sunlight is recommended.

How should 1,3-Thiazinane-2-carboxylic acid (CAS: 78233-48-4) be stored?

1,3-Thiazinane-2-carboxylic acid (CAS: 78233-48-4) should be stored in a cool, dry place, preferably under nitrogen atmosphere to prevent moisture absorption. Keep the container tightly sealed to maintain purity. Avoid exposure to direct sunlight and high temperatures. Store it away from incompatible materials such as strong oxidizers and acidic substances.