1-Chloro-3,5-diisopropylbenzene

Basic Information

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CAS Number

87945-06-0

Molecular Formula

C12H17Cl

Molecular Weight

196.72 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

221 ºC

Density

0.976

Flash Point

106 ºC

SMILES

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CC(C)C1=CC(=CC(=C1)Cl)C(C)C

InChI

InChI=1S/C12H17Cl/c1-8(2)10-5-11(9(3)4)7-12(13)6-10/h5-9H,1-4H3

InChIKey

IJPBANLIWUXUPV-UHFFFAOYSA-N

LogP

4.586800000000003

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

135

Synonyms & References

English

CS-0061025
A15870
1-chloro-3,5-bis(propan-2-yl)benzene
DTXSID40236705
1-chloro-3,5-di(propan-2-yl)benzene
SCHEMBL11574451
1-Chloro-3,5-diisopropylbenzene
AKOS005145956
BCP27192
AS-60634
3,5-Diisopropyl-1-chlorobenzene
87945-06-0
FT-0651472
Benzene,1-chloro-3,5-bis(1-methylethyl)-
3,5-DIISOPROPYL-1-CHLOROBENZENE
Benzene,1-chloro-3,5-bis(1-methylethyl)
5-Chloro-1,3-diisopropylbenzene

MDL Number

MFCD11053608

Customs Code

2903999090

FAQ

What is 1-Chloro-3,5-diisopropylbenzene (CAS: 87945-06-0)?

1-Chloro-3,5-diisopropylbenzene is an organic compound with the CAS number 87945-06-0. It is a benzene derivative with a chlorine atom and two isopropyl groups attached at the 1, 3, and 5 positions. This compound is colorless and has a faint aromatic odor. It is used in various applications, including pharmaceuticals and chemical synthesis.

What are the main uses of 1-Chloro-3,5-diisopropylbenzene (CAS: 87945-06-0)?

1-Chloro-3,5-diisopropylbenzene is primarily used in the synthesis of pharmaceuticals and chemical intermediates. It serves as a key building block in the development of certain drugs and is also used in the production of other organic compounds.

Is 1-Chloro-3,5-diisopropylbenzene (CAS: 87945-06-0) safe?

1-Chloro-3,5-diisopropylbenzene is generally considered safe when handled with appropriate precautions. It is flammable and can cause skin and eye irritation. Users should wear appropriate personal protective equipment, such as gloves and goggles, and follow safety guidelines to minimize exposure.

How should 1-Chloro-3,5-diisopropylbenzene (CAS: 87945-06-0) be stored?

1-Chloro-3,5-diisopropylbenzene 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 prevent evaporation and contamination. Proper ventilation is recommended during storage to avoid the accumulation of flammable vapors.