2-(1H-Indol-3-yl)ethanimidic acid

Basic Information

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CAS Number

879-37-8

Molecular Formula

C10H10N2O

Molecular Weight

174.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

152.0 to 156.0 deg-C

Boiling Point

469.7°C at 760 mmHg

Density

1.285 g/cm1.285

Flash Point

237.8 °C

Refractive Index

1.687

SMILES

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NC(=O)Cc1c[nH]c2ccccc12

InChI

InChI=1S/C10H10N2O/c11-10(13)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,12H,5H2,(H2,11,13)

InChIKey

ZOAMBXDOGPRZLP-UHFFFAOYSA-N

LogP

1.1956999999999998

Topological Polar Surface Area

58.88 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

205

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Indole-3-acetamide
1H-Indol-3-ylacetamide
1H-Indole-3-acetamide
2-(1H-INDOL-3-YL)ACETAMIDE
INDOLE-3-ACETAMIDE CRYSTALLINE
3-Indoleacetamide
3-Indolylacetamide
NSC 1969
Indoleacetamide
(indol-3-yl)acetamide
C10H10N2O
1-Indole-3-acetamide
2-(3-Indolyl)acetamide
(1H-indol-3-yl)acetamide
Indole-3-acetamide (8CI)
O9SEW65XW3
Indole-3-acetamide (6CI,8CI)
ZOAMBXDOGPRZLP-UHFFFAOYSA-N
2-indol-3-ylacetamide
TSR
PubChem7350
1H-indol-3-yl-acetamide
3-INDOLE ACETAMIDE
bmse000696
Indole-3
2-(1H-indol-3-yl)acetamide
Indole-3-acetamide (6CI, 8CI)
2-(1H-Indol-3-yl)acetamide

MDL Number

MFCD00005641

Customs Code

2933990090

FAQ

What is 2-(1H-Indol-3-yl)ethanimidic acid (CAS: 879-37-8)?

2-(1H-Indol-3-yl)ethanimidic acid (CAS: 879-37-8) is a heterocyclic organic compound containing an indole ring and an ethanimidic acid group. It is typically a white to off-white solid with a molecular formula of C11H10N2O2 and a molar mass of 206.22 g/mol. The compound is known for its potential applications in medicinal chemistry due to its structural similarity to various bioactive molecules.

What are the main uses of 2-(1H-Indol-3-yl)ethanimidic acid (CAS: 879-37-8)?

2-(1H-Indol-3-yl)ethanimidic acid (CAS: 879-37-8) is primarily used in pharmaceutical research as a building block for the synthesis of drugs targeting neurological and inflammatory conditions. It may also find applications in organic synthesis, chemical intermediates, and as a candidate for developing new therapeutic agents. Its indole core suggests potential activity in biological systems, making it relevant in drug discovery and medicinal chemistry.

Is 2-(1H-Indol-3-yl)ethanimidic acid (CAS: 879-37-8) safe?

2-(1H-Indol-3-yl)ethanimidic acid (CAS: 879-37-8) is generally considered safe when handled properly, but it should be treated with caution. As a chemical compound, it may have irritant properties, so protective gloves and goggles are recommended. It is important to follow standard safety protocols and handle it in a well-ventilated area to minimize exposure risks.

How should 2-(1H-Indol-3-yl)ethanimidic acid (CAS: 879-37-8) be stored?

2-(1H-Indol-3-yl)ethanimidic acid (CAS: 879-37-8) should be stored in a tightly sealed container in a cool, dry, and well-ventilated place, away from direct light. It is stable under normal storage conditions but should be kept at a temperature below 25°C and humidity levels below 60% to prevent degradation. Avoid exposure to moisture and incompatible substances during storage.