CAS 78834-75-0

Heptanoic acid, 7-chloro-2-oxo-, ethyl ester

Description:

Heptanoic acid, 7-chloro-2-oxo-, ethyl ester, with the CAS number 78834-75-0, is an organic compound that belongs to the class of esters. It is characterized by the presence of a heptanoic acid backbone, which is a seven-carbon saturated fatty acid, modified by the presence of a chloro group and a keto group at specific positions on the carbon chain. The ethyl ester functional group indicates that the compound is formed by the reaction of heptanoic acid with ethanol, resulting in the esterification process. This compound is likely to be a colorless to pale yellow liquid with a characteristic odor, typical of esters. It may exhibit moderate solubility in organic solvents and limited solubility in water due to its hydrophobic nature. The presence of the chloro and keto groups can impart unique chemical reactivity, making it of interest in various synthetic applications, including pharmaceuticals and agrochemicals. As with many organic compounds, safety precautions should be taken when handling this substance, as it may pose health risks if ingested or inhaled.

Formula: C₉H₁₅ClO₃

InChI: InChI=1S/C9H15ClO3/c1-2-13-9(12)8(11)6-4-3-5-7-10/h2-7H2,1H3

InChI key: InChIKey=YJJLIIMRHGRCFM-UHFFFAOYSA-N

SMILES: C(C(OCC)=O)(CCCCCCl)=O

Synonyms:

• ECO
• Ethyl 7-chloro-2-oxohepanoate
• Ethyl-7-chlor-2-oxoheptanoat
• Heptanoic Acid, 7-Chloro-2-Oxo-, Ethyl Ester
• Ethyl 7-chloro-2-oxoheptanoate

Ethyl 7-chloro-2-oxoheptanoate

CAS: 78834-75-0

Formula: C₉H₁₅ClO₃

Purity: 95%

Color and Shape: Liquid

Molecular weight: 206.6666

Ref: IN-DA003QDU

Ethyl 7-chloro-2-oxoheptanoate

CAS: 78834-75-0

Ethyl 7-chloro-2-oxoheptanoate

Purity: 98%

Molecular weight: 206.67g/mol

Ref: 54-OR471613

Ethyl 7-Chloro-2-oxoheptanoate

CAS: 78834-75-0

Formula: C₉H₁₅ClO₃

Purity: >98.0%(GC)

Color and Shape: Colorless to Light orange to Yellow clear liquid

Molecular weight: 206.67

Ref: 3B-E0827

Cilastatin Impurity 16

CAS: 78834-75-0

Formula: C₉H₁₅ClO₃

Molecular weight: 206.67

Ref: 4Z-C-136031

Ethyl 7-chloro-2-oxoheptanoate

CAS: 78834-75-0

Formula: C₉H₁₅ClO₃

Purity: 95%

Color and Shape: Liquid

Molecular weight: 206.67

Ref: 10-F200962

Ethyl 7-Chloro-2-oxoheptanoate

Controlled Product

CAS: 78834-75-0

Applications Ethyl 7-Chloro-2-oxoheptanoate is a reagent used in the synthesis of selective BCL-XL inhibitor A1155463 used in the treatment of cancer.
References Tao, Z. et al.: ACS Med. Cem. Lett., 5, 1088 (2014);

Formula: C₉H₁₅ClO₃

Color and Shape: Neat

Molecular weight: 206.67

Ref: TR-E901785