N-Formyl-3-mercaptovaline

Basic Information

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CAS Number

158411-82-6

Molecular Formula

C6H11NO3S

Molecular Weight

177.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Physical Properties

Melting Point

>138°C (dec.)

Boiling Point

385.7±37.0 °C at 760 mmHg

Density

1.2±0.1 g/cm3

Flash Point

187.0±26.5 °C

Solubility

DMSO (Slightly), Methanol (Slightly)

Vapor Pressure

0.0±1.9 mmHg at 25°C

SMILES

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CC(C)(C(C(=O)O)NC=O)S

InChI

InChI=1S/C6H11NO3S/c1-6(2,11)4(5(9)10)7-3-8/h3-4,11H,1-2H3,(H,7,8)(H,9,10)

InChIKey

ANCLDHSEMKEXLS-UHFFFAOYSA-N

LogP

-0.10600000000000026

Topological Polar Surface Area

66.4 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

169

Synonyms & References

English

N-formylpenicillamin
(R)-2-Formamido-3-mercapto-3-methylbutanoic acid
2-formamido-3-mercapto-3-methylbutanoic acid

FAQ

What is N-Formyl-3-mercaptovaline (CAS: 158411-82-6)?

N-Formyl-3-mercaptovaline is an organic compound with the CAS number 158411-82-6. It is a derivative of valine, featuring a formyl group and a mercapto group. This compound is typically used in research and pharmaceutical development due to its unique chemical properties.

What are the main uses of N-Formyl-3-mercaptovaline (CAS: 158411-82-6)?

N-Formyl-3-mercaptovaline (CAS: 158411-82-6) is primarily used in research and pharmaceutical development. It serves as a useful reagent in synthesizing other compounds and as a model compound for studying biological systems.

Is N-Formyl-3-mercaptovaline (CAS: 158411-82-6) safe?

N-Formyl-3-mercaptovaline (CAS: 158411-82-6) is generally safe when handled with appropriate precautions. However, it should be used in a well-ventilated area and handled with gloves and goggles to protect against skin contact and inhalation. Avoid contact with eyes and ingestion.

How should N-Formyl-3-mercaptovaline (CAS: 158411-82-6) be stored?

N-Formyl-3-mercaptovaline (CAS: 158411-82-6) should be stored in a sealed container to prevent moisture absorption. It should be kept in a cool, dry place away from direct sunlight and heat sources. Store it at a temperature between 0°C and 25°C to maintain its stability and purity.