CAS 7452-59-7

Octyl carbonochloridate

Description:

Octyl carbonochloridate, also known as octyl chloroformate, is an organic compound characterized by its ester functional group derived from carbonic acid and octanol. It typically appears as a colorless to pale yellow liquid with a distinctive odor. This compound is known for its reactivity, particularly as a reagent in organic synthesis, where it is often used for the introduction of the octyl group into various organic molecules. Octyl carbonochloridate is soluble in organic solvents such as dichloromethane and ether but is generally insoluble in water due to its hydrophobic nature. It is important to handle this compound with care, as it can be corrosive and may cause irritation to the skin, eyes, and respiratory system. Proper safety precautions, including the use of personal protective equipment and working in a well-ventilated area, are essential when working with this chemical. Its applications extend to the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals, making it a valuable reagent in the field of organic chemistry.

Formula: C₉H₁₇ClO₂

InChI: InChI=1/C9H17ClO2/c1-2-3-4-5-6-7-8-12-9(10)11/h2-8H2,1H3

InChI key: InChIKey=VFXVAXFIFHSGNR-UHFFFAOYSA-N

SMILES: C(CCCCCC)COC(Cl)=O

Synonyms:

• 1-Octyl chloroformate
• 231-224-9
• Carbonochloridic acid, octyl ester
• Formic acid, chloro-, octyl ester
• Octyl carbonochloridate
• Octyl chloroformate
• n-Octyl Chloroformate
• CHLOROFORMIC ACID N-OCTYL ESTER
• Carbo-n-octyloxyChloride
• carbonochloridicacid,octylester
• Octyl carbonochloridic acid
• Octyl chloroforMate 97%
• Octyl chloroformate,97%
• Chloridocarbonic acid octyl ester

n-Octyl Chloroformate

CAS: 7452-59-7

Formula: C₉H₁₇ClO₂

Purity: >97.0%(GC)(T)

Color and Shape: Colorless to Almost colorless clear liquid

Molecular weight: 192.68

Ref: 3B-C0724

Octyl chloroformate

CAS: 7452-59-7

Formula: C₉H₁₇ClO₂

Purity: 97%

Color and Shape: Liquid

Molecular weight: 192.6831

Ref: IN-DA003OTT

N-Octyl Chloroformate

CAS: 7452-59-7

N-Octyl Chloroformate

Purity: 97%

Molecular weight: 192.68g/mol

Ref: 54-OR1025209

n-Octyl Chloroformate

Controlled Product

CAS: 7452-59-7

Stability Moisture Sensitive
Applications n-Octyl Chloroformate is a chemical reagent used in the synthesis of surfactants derived from N-alkoxycarbonyl amino acids. Also used n the preparation of piperazinyl-glutamate-pyridines used as orally bioavailable P2Y12 antagonists in platelet aggregation.
References Kawase, T. et al.: J. Oleo. Sci., 59, 191 (2010); Parlow, J. et al.: Bioorg. Med. Chem. Lett., 19, 4657 (2009);

Formula: C₉H₁₇ClO₂

Color and Shape: Neat

Molecular weight: 192.68

Ref: TR-O239980