5-(Benzyloxy)-1H-indole-3-carbaldehyde

Basic Information

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CAS Number

6953-22-6

Molecular Formula

C16H13NO2

Molecular Weight

251.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Ethers

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

Physical State

Pale-yellow to Yellow-brown Solid

Melting Point

237-238°C

Boiling Point

474.2°C at 760 mmHg

Density

1.267

Flash Point

240.6 °C

SMILES

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C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3C=O

InChI

InChI=1S/C16H13NO2/c18-10-13-9-17-16-7-6-14(8-15(13)16)19-11-12-4-2-1-3-5-12/h1-10,17H,11H2

InChIKey

DJGNUBADRQIDNQ-UHFFFAOYSA-N

LogP

3.559400000000002

Topological Polar Surface Area

42.09 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

301

Safety Information

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GHS Hazard Pictograms

H317

H319

Hazard Statement

H317 May cause an allergic skin reaction
Sensitization, Skin

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Class AIR SENSITIVE Class AIR SENSITIVE

Sensitiveness

Air Sensitive

Synonyms & References

English

CHEMBL1592937
5-benzyloxy-1h-indole-3-carbaldehyde
DTXSID90219785
EINECS 230-134-7
5-(benzyloxy)-1H-indole-3-carbaldehyde;5-Benzyloxyindole-3-carbaldehyde
5-(Benzyloxy)-1H-indole-3-carbaldehyde #
5-Benzyloxyindole-3-carboxaldehyde, powder
5-Benzyloxy-3-indolecarboxaldehyde
DS-0066
HMS3052E22
AM20060948
FT-0620054
MFCD00014562
5-Benzyloxyindole-3-carboxaldehyde
6953-22-6
B-1870
5-Benzyloxyindole-3- carboxaldehyde
SMR001224347
1H-Indole-3-carboxaldehyde, 5-(phenylmethoxy)-
SY026618
AC-18163
5-(benzyloxy)-1h-indole-3-carboxaldehyde
5-(Benzyloxy)-1H-indole-3-carbaldehyde
5-Benzyloxyindole-3-carbaldehyde
AKOS005207077
5-Benzyloxyindol-3-aldehyde
A9195
AC-24616
MLS001360008
AB01159
SCHEMBL1791105

MDL Number

MFCD00014562

Customs Code

29339990

FAQ

What is 5-(Benzyloxy)-1H-indole-3-carbaldehyde (CAS: 6953-22-6)?

5-(Benzyloxy)-1H-indole-3-carbaldehyde is an organic compound with the CAS number 6953-22-6. It is a derivative of indole with a carboxaldehyde group and a benzyloxy group. The compound is characterized by its aromatic nature and potential for use in medicinal chemistry and synthetic organic chemistry.

What are the main uses of 5-(Benzyloxy)-1H-indole-3-carbaldehyde (CAS: 6953-22-6)?

5-(Benzyloxy)-1H-indole-3-carbaldehyde is primarily used in medicinal chemistry for the synthesis of various bioactive compounds. It is also utilized in academic and industrial research for the development of new drug candidates and as a building block in organic synthesis.

Is 5-(Benzyloxy)-1H-indole-3-carbaldehyde (CAS: 6953-22-6) safe?

5-(Benzyloxy)-1H-indole-3-carbaldehyde is generally safe when handled with appropriate precautions. Users should avoid skin and eye contact, and wear personal protective equipment such as gloves and safety goggles. Storage and handling should be done in a well-ventilated area to minimize inhalation risk.

How should 5-(Benzyloxy)-1H-indole-3-carbaldehyde (CAS: 6953-22-6) be stored?

5-(Benzyloxy)-1H-indole-3-carbaldehyde should be stored in a tightly sealed container in a cool, dry place away from direct sunlight. Optimal storage conditions include a temperature range of 15-25°C and a relative humidity below 60%. It is important to keep the compound away from heat and sources of ignition.