CAS 70289-38-2

4-Chloro-1-[4-(1-methylethyl)phenyl]-1-butanone

Description:

4-Chloro-1-[4-(1-methylethyl)phenyl]-1-butanone, with the CAS number 70289-38-2, is an organic compound characterized by its structure, which includes a butanone backbone substituted with a chloro group and a para-isopropylphenyl group. This compound typically appears as a colorless to pale yellow liquid or solid, depending on its physical state at room temperature. It is known for its potential applications in organic synthesis and as an intermediate in the production of various pharmaceuticals and agrochemicals. The presence of the chloro substituent can influence its reactivity, making it a useful building block in chemical reactions, particularly in electrophilic aromatic substitution. Additionally, the isopropyl group contributes to its hydrophobic characteristics, affecting its solubility in different solvents. Safety data indicates that, like many chlorinated compounds, it should be handled with care due to potential toxicity and environmental concerns. Proper storage and handling protocols are essential to mitigate risks associated with exposure.

Formula: C₁₃H₁₇ClO

InChI: InChI=1/C13H17ClO/c1-10(2)11-5-7-12(8-6-11)13(15)4-3-9-14/h5-8,10H,3-4,9H2,1-2H3

InChI key: InChIKey=BGOQEVLEIPPQID-UHFFFAOYSA-N

SMILES: C(CCCCl)(=O)C1=CC=C(C(C)C)C=C1

Synonyms:

• 1-Butanone, 4-chloro-1-[4-(1-methylethyl)phenyl]-
• 3-Chloropropyl 4-isopropylphenyl ketone
• 4-Chloro-1-(4-isopropylphenyl)-1-butanone
• 4-Chloro-1-[4-(1-methylethyl)phenyl]-1-butanone
• 4-Chloro-1-[4-(Propan-2-Yl)Phenyl]Butan-1-One
• Butyrophenone, 4-chloro-4′-isopropyl-
• NSC 163136
• 4-Chloro-4'-isopropylbutyrophenone

4-Chloro-4'-isopropyl-butyrophenone

Controlled Product

CAS: 70289-38-2

Formula: C₁₃H₁₇OCl

Color and Shape: Neat

Molecular weight: 224.72

Ref: TR-C385918