3-Hydroxy-1-methyl-5,6-indolinedione

Basic Information

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CAS Number

54-06-8

Molecular Formula

C9H9NO3

Molecular Weight

179.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

115-120°C

Boiling Point

311.69°C (rough estimate)

Refractive Index

1.5600 (estimate)

SMILES

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CN1CC(C2=CC(=O)C(=O)C=C21)O

InChI

InChI=1S/C9H9NO3/c1-10-4-9(13)5-2-7(11)8(12)3-6(5)10/h2-3,9,13H,4H2,1H3

InChIKey

RPHLQSHHTJORHI-UHFFFAOYSA-N

LogP

-0.7452000000000001

Topological Polar Surface Area

57.61 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

354

Synonyms & References

English

CS-0065676
A-3200
3-hydroxy-1-methyl-2,3-dihydro-1H-indole-5,6-dione
AKOS006229902
Q366835
2,3-Dihydro-3-hydroxy-1-methyl-1H-indole-5,6-dione
D,L-Adrenochrome
1H-Indole-5,6-dione, 2,3-dihydro-3-hydroxy-1-methyl-
NS00041209
3-Hydroxy-1-methylindoline-5,6-dione
UNII-70G54NQL71
FT-0621930
SCHEMBL61927
3-Hydroxy-1-methyl-5,6-indolinedione
NSC407840
NSC383491
Adraxone
7506-92-5
NCGC00163348-01
ADRENOCHROME [MI]
MFCD00069732
3-hydroxy-1-methyl-2,3,5,6-tetrahydro-1H-indole-5,6-dione
Adrenochrom
EINECS 200-192-8
DTXSID00871530
3-hydroxy-1-methyl-2,3-dihydroindole-5,6-dione
Adrenochrome
USAF uctl-7
54-06-8
5,6-INDOLINEDIONE, 3-HYDROXY-1-METHYL-
BCP30577

MDL Number

MFCD00069732

Customs Code

2933990090

FAQ

What is 3-Hydroxy-1-methyl-5,6-indolinedione (CAS: 54-06-8)?

3-Hydroxy-1-methyl-5,6-indolinedione (CAS: 54-06-8) is a stable organic compound with a molecular formula of C10H8N2O2. It is a derivative of indole with a hydroxyl group at the 3-position and a methyl group at the 1-position. This compound is often used as a precursor in chemical synthesis and research.

What are the main uses of 3-Hydroxy-1-methyl-5,6-indolinedione (CAS: 54-06-8)?

3-Hydroxy-1-methyl-5,6-indolinedione (CAS: 54-06-8) is primarily used as a synthetic intermediate in the pharmaceutical industry, particularly in the development of indole-based drugs. It also serves as a reagent in organic chemistry and research.

Is 3-Hydroxy-1-methyl-5,6-indolinedione (CAS: 54-06-8) safe?

3-Hydroxy-1-methyl-5,6-indolinedione (CAS: 54-06-8) is generally considered safe when handled with appropriate precautions. It is important to follow standard safety guidelines, including the use of personal protective equipment (PPE) and proper ventilation during handling.

How should 3-Hydroxy-1-methyl-5,6-indolinedione (CAS: 54-06-8) be stored?

3-Hydroxy-1-methyl-5,6-indolinedione (CAS: 54-06-8) should be stored in a cool, dry place away from direct sunlight. It should be kept in a tightly sealed container to prevent exposure to moisture and air. Storage temperatures should be below 25°C to preserve its stability.