5-Methoxy-1H-indole

Basic Information

View in Editor

CAS Number

1006-94-6

Molecular Formula

C9H9NO

Molecular Weight

147.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Physical State

Yellow to Brown Solid

Melting Point

54.0 to 58.0 deg-C

Boiling Point

178°C/17mmHg

Flash Point

176-178°C/17mm

Refractive Index

1.5310 (estimate)

SMILES

View in Editor

COC1=CC2=C(C=C1)NC=C2

InChI

InChI=1S/C9H9NO/c1-11-8-2-3-9-7(6-8)4-5-10-9/h2-6,10H,1H3

InChIKey

DWAQDRSOVMLGRQ-UHFFFAOYSA-N

LogP

2.1765

Topological Polar Surface Area

25.02 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

138

Safety Information

View Safety Information

GHS Hazard Pictograms

H315

H319

H335

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

Hazard Class

Class IRRITANT Class IRRITANT

Class KEEP COLD Class KEEP COLD

Class LIGHT SENSITIVE Class LIGHT SENSITIVE

Sensitiveness

Light Sensitive

Synonyms & References

English

CS-W007328
NS00015812
Methoxy-5 indole [French]
5-METHOXYINDOLE
5-(methyloxy)-1H-indole
BCP26682
HY-W007328
STR01848
AKOS000121317
AC-10504
AB-337/25021007
916979-77-6
1H-Indol-5-yl methyl ether #
CG-0503
3img
Methoxy-5 indole
1006-94-6
SCHEMBL74720
1H-Indole, 5-methoxy-
CHEMBL280311
A16217
1,3-dihydro-5-methyl-2H-Indol-2-one
SY004368
NSC 521752
NSC-521752
CHEBI:167807
InChI=1/C9H9NO/c1-11-8-2-3-9-7(6-8)4-5-10-9/h2-6,10H,1H
BP-10264
BZ3
Q27276543
M0731

MDL Number

MFCD00005674

Customs Code

2933990090

FAQ

What is 5-Methoxy-1H-indole (CAS: 1006-94-6)?

5-Methoxy-1H-indole (CAS: 1006-94-6) is a heterocyclic organic compound with the chemical formula C8H9NO. It features an indole ring system substituted with a methoxy group at the 5-position. This compound is known for its aromatic properties and is commonly used in pharmaceutical and research applications. Its molecular structure makes it a valuable intermediate in the synthesis of various bioactive molecules.

What are the main uses of 5-Methoxy-1H-indole (CAS: 1006-94-6)?

5-Methoxy-1H-indole (CAS: 1006-94-6) is primarily utilized in pharmaceutical research as a precursor for developing drugs targeting neurological disorders. It also serves in organic synthesis for creating indole derivatives and has applications in industrial chemistry. Additionally, it is studied in academic research for its potential roles in biochemistry and material science, though its use in food or consumer products is limited.

Is 5-Methoxy-1H-indole (CAS: 1006-94-6) safe?

5-Methoxy-1H-indole (CAS: 1006-94-6) is generally considered safe when handled properly, but it requires standard safety precautions. It has low toxicity in short-term exposure, though prolonged contact may pose risks. Always use protective gloves, eyewear, and ensure adequate ventilation. Safety data sheets (SDS) recommend avoiding inhalation and skin contact, and proper disposal methods should be followed to comply with chemical safety standards.

How should 5-Methoxy-1H-indole (CAS: 1006-94-6) be stored?

5-Methoxy-1H-indole (CAS: 1006-94-6) should be stored in a cool, dry, and dark place, ideally below 25°C. Keep it in a sealed, airtight container to prevent moisture absorption and contamination. Avoid exposure to light and incompatible substances. Due to its chemical stability under normal conditions, it does not require refrigeration but should be protected from humidity and direct sunlight to maintain integrity.