3-Bromo-9H-xanthen-9-one

Basic Information

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CAS Number

500286-36-2

Molecular Formula

C13H7BrO2

Molecular Weight

275.1 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1=CC=C2C(=C1)C(=O)C3=C(O2)C=C(C=C3)Br

InChI

InChI=1S/C13H7BrO2/c14-8-5-6-10-12(7-8)16-11-4-2-1-3-9(11)13(10)15/h1-7H

InChIKey

UEKROUJUENOVKW-UHFFFAOYSA-N

LogP

3.708700000000002

Topological Polar Surface Area

30.21 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

292

Synonyms & References

English

9H-Xanthen-9-one, 3-bromo-
3-bromo-9H-Xanthen-9-one
MFCD20528061
UEKROUJUENOVKW-UHFFFAOYSA-N
HMS3080G11
CS-0343004
3-bromoxanthen-9-one
SMR001548653
DA-23930
F83710
B6193
3-Bromo-xanthen-9-one
500286-36-2
SCHEMBL490127
3-Bromoxanthenon
NSC28061
MLS002639206
3-Bromo-9H-xanthen-9-one
CHEMBL1704560
NSC-28061

MDL Number

MFCD20528061

FAQ

What is 3-Bromo-9H-xanthen-9-one (CAS: 500286-36-2)?

3-Bromo-9H-xanthen-9-one is an organic compound with the CAS number 500286-36-2. It is a yellow crystalline solid with a molecular formula of C14H9BrO2. This compound is used in various scientific and industrial applications due to its unique chemical properties.

What are the main uses of 3-Bromo-9H-xanthen-9-one (CAS: 500286-36-2)?

3-Bromo-9H-xanthen-9-one is primarily used in pharmaceuticals for the synthesis of certain compounds and in research for studying xanthenes. It also finds applications in organic chemistry as a reagent and in the dye industry for the production of specific dyes.

Is 3-Bromo-9H-xanthen-9-one (CAS: 500286-36-2) safe?

3-Bromo-9H-xanthen-9-one (CAS: 500286-36-2) is generally considered safe when handled with appropriate precautions. However, it is important to follow safety guidelines, including the use of personal protective equipment, to avoid skin contact and inhalation. Storage should be in a cool, dry place away from heat and direct sunlight.

How should 3-Bromo-9H-xanthen-9-one (CAS: 500286-36-2) be stored?

3-Bromo-9H-xanthen-9-one (CAS: 500286-36-2) should be stored in a tightly sealed container at room temperature or slightly below. It should be kept away from heat, moisture, and direct sunlight. Proper ventilation should be ensured, and it should be stored in a secure place out of reach of children and pets.