1-(4-Bromophenyl)-1-heptanone

Basic Information

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CAS Number

99474-02-9

Molecular Formula

C13H17BrO

Molecular Weight

269.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

59-60°C

SMILES

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CCCCCCC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C13H17BrO/c1-2-3-4-5-6-13(15)11-7-9-12(14)10-8-11/h7-10H,2-6H2,1H3

InChIKey

LDVBFPQTLJKTLV-UHFFFAOYSA-N

LogP

4.602200000000003

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

183

Synonyms & References

English

DivK1c_001221
FT-0605665
CCG-233187
DTXSID30379670
4-Bromoheptanophenone
HMS548I05
1-(4-bromophenyl)heptan-1-one
1-Bromo-4-n-heptanoylbenzene
AKOS009156426
Maybridge1_002469
MFCD00276567
99474-02-9
AS-58929
1-(4-Bromo-phenyl)-heptan-1-one
SCHEMBL7789291
CDS1_000181
ZDA47402
CS-0321589
4'-Bromoheptanophenone
F21440
2,3,4,5,6-PENTAFLUOROBENZHYDROL
1-(4-bromo-phenyl)-heptan-1-one
1-(4-Brom-phenyl)-heptan-1-on
1-bromo-4-heptanoylbenzene

MDL Number

MFCD00276567

Customs Code

2914700090

FAQ

What is 1-(4-Bromophenyl)-1-heptanone (CAS: 99474-02-9)?

1-(4-Bromophenyl)-1-heptanone is an organobromine compound with the CAS number 99474-02-9. It is a colorless to light yellow oily liquid with a distinctive odor. This compound is used in various industries, including pharmaceuticals, agrochemicals, and as a precursor in organic synthesis.

What are the main uses of 1-(4-Bromophenyl)-1-heptanone (CAS: 99474-02-9)?

1-(4-Bromophenyl)-1-heptanone (CAS: 99474-02-9) is primarily used as a chemical intermediate in the synthesis of other compounds. It is also utilized in the pharmaceutical industry as a precursor for the development of new drugs. Additionally, it has applications in agrochemicals and as a reagent in organic synthesis.

Is 1-(4-Bromophenyl)-1-heptanone (CAS: 99474-02-9) safe?

1-(4-Bromophenyl)-1-heptanone (CAS: 99474-02-9) is generally safe when handled with appropriate precautions. However, it is important to follow safety guidelines, including the use of personal protective equipment such as gloves and goggles. Storage in a cool, dry place away from direct sunlight is recommended to prevent degradation.

How should 1-(4-Bromophenyl)-1-heptanone (CAS: 99474-02-9) be stored?

1-(4-Bromophenyl)-1-heptanone (CAS: 99474-02-9) should be stored in a cool, dry place with a temperature below 30°C (86°F). Avoid exposure to direct sunlight and store in a well-ventilated area. Use a tightly sealed container to prevent evaporation and ensure the compound remains stable.