Methyl 3-amino-3-thioxopropanoate

Basic Information

View in Editor

CAS Number

689-09-8

Molecular Formula

C4H7NO2S

Molecular Weight

133.17 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

Basic Chemical Raw Materials Organic Chemicals Amines

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Density

1.247

SMILES

View in Editor

COC(=O)CC(=S)N

InChI

InChI=1S/C4H7NO2S/c1-7-4(6)2-3(5)8/h2H2,1H3,(H2,5,8)

InChIKey

DVXKSWIBOSXJRV-UHFFFAOYSA-N

LogP

-0.1644

Topological Polar Surface Area

52.32 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

113

Synonyms & References

English

methyl 3-amino-3-sulfanylidenepropanoate
CS-0246007
A9146
SY007662
CS-11167
SCHEMBL11879974
methyl thiocarbamoylacetate
SCHEMBL6040697
DTXSID70218973
MFCD02101412
AC2409
EN300-31511
Propanoic acid, 3-amino-3-thioxo-, methyl ester
Methyl3-Amino-3-thioxopropanoate
689-09-8
methyl 3-amino-3-thioxopropanoate
DVXKSWIBOSXJRV-UHFFFAOYSA-N
FT-0728678
AKOS000164341
methyl 2-carbamothioylacetate
Propanoic acid,3-amino-3-thioxo-, methyl ester
2-(carbomethoxy)thioacetamide
3-thio-malonamic acid methyl ester
methoxycarbonylthioacetamide
Methyl 2-thiocarbamoylacetate
methyl malonate monothioamide
thioamidomethyl malonate
PubChem16742
methyl 3-amino-3-thioxo-propanoate
7011AJ
NE43525

MDL Number

MFCD02101412

Customs Code

2930909090

FAQ

What is Methyl 3-amino-3-thioxopropanoate (CAS: 689-09-8)?

Methyl 3-amino-3-thioxopropanoate (CAS: 689-09-8) is a chemical compound with the formula CH3C(S)N(CH3)2. It is characterized by its thioether and amine functionalities, making it useful in various applications due to its reactivity and solubility.

What are the main uses of Methyl 3-amino-3-thioxopropanoate (CAS: 689-09-8)?

Methyl 3-amino-3-thioxopropanoate (CAS: 689-09-8) is primarily used in pharmaceuticals as an intermediate for drug synthesis, in research for its unique chemical properties, and in some industrial applications such as in the synthesis of dyes and other organic compounds.

Is Methyl 3-amino-3-thioxopropanoate (CAS: 689-09-8) safe?

Methyl 3-amino-3-thioxopropanoate (CAS: 689-09-8) can be safe when handled with proper precautions. It is important to use personal protective equipment, such as gloves and goggles, and ensure good ventilation during handling. Additionally, it should be stored away from heat and sources of ignition to prevent decomposition or fire.

How should Methyl 3-amino-3-thioxopropanoate (CAS: 689-09-8) be stored?

Methyl 3-amino-3-thioxopropanoate (CAS: 689-09-8) should be stored in tightly sealed containers at room temperature, protecting it from heat, moisture, and light to maintain its stability. It should be kept in a well-ventilated area and away from any potential ignition sources.