3-Cyclohexyl-1H-indole-6-carboxylic acid

Basic Information

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CAS Number

494799-17-6

Molecular Formula

C15H17NO2

Molecular Weight

243.31 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

486.3°C at 760 mmHg

SMILES

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C1CCC(CC1)C2=CNC3=C2C=CC(=C3)C(=O)O

InChI

InChI=1S/C15H17NO2/c17-15(18)11-6-7-12-13(9-16-14(12)8-11)10-4-2-1-3-5-10/h6-10,16H,1-5H2,(H,17,18)

InChIKey

OZJSQVKDKOOQIT-UHFFFAOYSA-N

LogP

3.913800000000002

Topological Polar Surface Area

53.09 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

312

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H317 May cause an allergic skin reaction
Sensitization, Skin

Synonyms & References

English

3-cyclohexyl-1H-indole-6-carboxylicacid
SY116731
DS-12608
3-Cyclohexane-1H-Indole-6-Carboxylic Acid
3-cyclohexyl-6-indole carboxylic acid
1H-Indole-6-carboxylicacid,3-cyclohexyl-
OZJSQVKDKOOQIT-UHFFFAOYSA-N
3-Cyclohexylindole-6-carboxylic acid
494799-17-6
AKOS016001369
CS-0077491
DTXSID70459864
O10995
SCHEMBL1173806
SB15022
3-cyclohexyl-1H-indole-6-carboxylic Acid
3-cyclohexylindole-6-carboxylicacid
A7380
FT-0647911
MFCD09833286
3-Cyclohexyl-1H-indole-6-carboxylic acid
1H-Indole-6-carboxylic acid, 3-cyclohexyl-
1H-Indole-6-carboxylic acid,3-cyclohexyl
BH167
6701AB
FC0208
AX8158895
3-cyclohexyl-1H-indole-6-carboxylic acid

MDL Number

MFCD09833286

Customs Code

2933990090

FAQ

What is 3-Cyclohexyl-1H-indole-6-carboxylic acid (CAS: 494799-17-6)?

3-Cyclohexyl-1H-indole-6-carboxylic acid (CAS: 494799-17-6) is a derivative of indole, featuring a cyclohexyl substituent on the indole ring. It is a solid, white to off-white powder with a molecular weight of approximately 227.25 g/mol. This compound exhibits pharmacological properties and is used in medicinal chemistry for drug discovery.

What are the main uses of 3-Cyclohexyl-1H-indole-6-carboxylic acid (CAS: 494799-17-6)?

3-Cyclohexyl-1H-indole-6-carboxylic acid (CAS: 494799-17-6) is primarily used in pharmaceutical research, specifically for the development of new drugs. It serves as a precursor or scaffold in synthetic chemistry for creating novel compounds with potential therapeutic applications.

Is 3-Cyclohexyl-1H-indole-6-carboxylic acid (CAS: 494799-17-6) safe?

3-Cyclohexyl-1H-indole-6-carboxylic acid (CAS: 494799-17-6) can be handled safely with appropriate precautions. It is not known to be toxic, but direct contact with eyes or ingestion should be avoided. Protective measures include wearing gloves, goggles, and a lab coat during handling. Adequate ventilation is also recommended.

How should 3-Cyclohexyl-1H-indole-6-carboxylic acid (CAS: 494799-17-6) be stored?

3-Cyclohexyl-1H-indole-6-carboxylic acid (CAS: 494799-17-6) should be stored in a cool, dry place, away from direct sunlight and heat sources. It should be kept in a tightly sealed container to protect it from moisture and air. Ideal storage conditions are below 25°C (77°F) with a relative humidity below 60%.