Hexyl carbonochloridate

Basic Information

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CAS Number

6092-54-2

Molecular Formula

C7H13ClO2

Molecular Weight

164.63 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Boiling Point

60-61 °C/7 mmHg

Density

1.007 g/mL at 25 °C

Refractive Index

n20/D 1.424(lit.)

Vapor Pressure

0.06 psi ( 20 °C)

SMILES

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CCCCCCOC(=O)Cl

InChI

InChI=1S/C7H13ClO2/c1-2-3-4-5-6-10-7(8)9/h2-6H2,1H3

InChIKey

KIWBRXCOTCXSSZ-UHFFFAOYSA-N

LogP

2.9421000000000017

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

93.6

Safety Information

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Hazard Statement

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 6.1(a) Class 6.1(a)

Synonyms & References

English

Hexyl carbonochloridate
Hexyl Chloroformate
Carbonochloridic acid, hexyl ester
chloroformic acid n-hexyl ester
DM-3
n-?Hexyl chloroformate
N-hexyl Chloroformate
Chloroformic Acid Hexyl Ester
Hexyl chlorocarbonate
KIWBRXCOTCXSSZ-UHFFFAOYSA-N
MU6004C2Z3
Hexyl chloroformate, 98%
hexylchloroformate
Hexyl=chloroformate
n-hexylchloroformate
Formic acid, chloro-, hexyl ester
n-HCF
Hexyl chloridocarbonate
Hexyl carbonochloridoate
chloro(hexyloxy)methanone
Ch
Chloroformic acid n-hexyl ester

MDL Number

MFCD00000651

Customs Code

2915900090

FAQ

What is Hexyl carbonochloridate (CAS: 6092-54-2)?

Hexyl carbonochloridate, with the CAS number 6092-54-2, is an organic compound that belongs to the class of carbonates. It has the chemical formula C8H16O2Cl and is characterized by its chlorinated ester structure. This compound is typically a colorless liquid with a mild odor and is known for its solubility in organic solvents. It is used primarily as an intermediate in chemical synthesis.

What are the main uses of Hexyl carbonochloridate (CAS: 6092-54-2)?

Hexyl carbonochloridate is mainly used in pharmaceutical and chemical industries as a key intermediate in the synthesis of various compounds. It finds applications in the production of drugs, perfumes, and other organic materials. Additionally, it is used in research for developing new chemical products and in some cases, as a precursor in the manufacturing of food-grade additives.

Is Hexyl carbonochloridate (CAS: 6092-54-2) safe?

Hexyl carbonochloridate is considered hazardous and should be handled with care. It may cause irritation to the skin, eyes, and respiratory system. Safety standards recommend using appropriate protective equipment such as gloves, goggles, and a fume hood. Proper ventilation and adherence to safety guidelines are essential when working with this compound.

How should Hexyl carbonochloridate (CAS: 6092-54-2) be stored?

Hexyl carbonochloridate should be stored in a cool, dry, and well-ventilated area away from heat and direct light. It is best kept in a sealed container made of glass or stainless steel to prevent contamination. Maintaining a storage temperature below 25°C and ensuring low humidity levels are crucial for its stability and shelf life.