1-Methyl-2-phenyl-1H-indole

Basic Information

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CAS Number

3558-24-5

Molecular Formula

C15H13N

Molecular Weight

207.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

98.0 to 102.0 deg-C

Boiling Point

380.8 ℃ at 760 mmHg

Flash Point

184.1oC

Refractive Index

1.5720 (estimate)

SMILES

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CN1C2=CC=CC=C2C=C1C3=CC=CC=C3

InChI

InChI=1S/C15H13N/c1-16-14-10-6-5-9-13(14)11-15(16)12-7-3-2-4-8-12/h2-11H,1H3

InChIKey

SFWZZSXCWQTORH-UHFFFAOYSA-N

LogP

3.8453000000000026

Topological Polar Surface Area

4.93 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

232

Safety Information

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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

Synonyms & References

English

A822887
Indole, 1-methyl-2-phenyl-
FT-0608050
3558-24-5
AB00775587-01
Z104479722
InChI=1/C15H13N/c1-16-14-10-6-5-9-13(14)11-15(16)12-7-3-2-4-8-12/h2-11H,1H
IE3UB978IA
NCGC00246339-01
2-Phenyl-N-methylindole
NSC-63793
n-methyl-2-phenyl-indole
AC8408
SY038925
1-methyl-2-phenyl-indole
N-Methyl-2-phenylindole
CS-W015261
CHEMBL1545735
1-Methyl-2-phenylindole, 99%
M0733
UNII-IE3UB978IA
1H-Indole, 1-methyl-2-phenyl-
NSC63793
n-methyl-2-phenyl indole
AKOS001426229
HMS2857M05
BP-13058
1-Methyl-2-phenylindole
SCHEMBL214075
2-phenyl-1-methylindole
SMR000543310

MDL Number

MFCD00022892

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 1-Methyl-2-phenyl-1H-indole (CAS: 3558-24-5)?

1-Methyl-2-phenyl-1H-indole (CAS: 3558-24-5) is a crystalline compound with a molecular weight of approximately 173.21 g/mol. It is slightly soluble in water but soluble in organic solvents such as ethanol and dichloromethane. Chemically, it is stable under normal conditions but can react with strong oxidizing agents. It is used in various applications due to its specific molecular structure.

How is 1-Methyl-2-phenyl-1H-indole (CAS: 3558-24-5) typically synthesized?

1-Methyl-2-phenyl-1H-indole (CAS: 3558-24-5) is typically synthesized via a condensation reaction of an aromatic amine with a substituted acetyl chloride, often using a mild base like triethylamine. The reaction is catalyzed by a phase-transfer catalyst, yielding a high purity product with good selectivity and yield.

What industries use 1-Methyl-2-phenyl-1H-indole (CAS: 3558-24-5)?

1-Methyl-2-phenyl-1H-indole (CAS: 3558-24-5) is primarily used in the pharmaceutical industry as a precursor for drug synthesis. It also finds applications in the production of dyes and pigments, as well as in the development of sensors and semiconductors.

What precautions should be taken when handling 1-Methyl-2-phenyl-1H-indole (CAS: 3558-24-5)?

When handling 1-Methyl-2-phenyl-1H-indole (CAS: 3558-24-5), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated fume hood to avoid inhalation. Spills should be cleaned up with care, using appropriate absorbent materials, and any waste should be disposed of according to local regulations. For detailed safety information, refer to the Safety Data Sheet (SDS).