1-Chloroethyl carbonochloridate

Basic Information

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CAS Number

50893-53-3

Molecular Formula

C3H4Cl2O2

Molecular Weight

142.97 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

Melting Point

-65°C

Boiling Point

120°C

Solubility

Miscible with most organic solvents.

Refractive Index

n20/D 1.422(lit.)

Vapor Pressure

3.25 psi ( 20 °C)

SMILES

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CC(OC(=O)Cl)Cl

InChI

InChI=1S/C3H4Cl2O2/c1-2(4)7-3(5)6/h2H,1H3

InChIKey

QOPVNWQGBQYBBP-UHFFFAOYSA-N

LogP

1.9466

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

73.3

Safety Information

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GHS Hazard Pictograms

H226

H302

H314

H331

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H302 Harmful if swallowed
Acute toxicity, oral

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

H331 Toxic if inhaled
Acute toxicity, inhalation

Hazard Class

Class 6.1 Class 6.1

Sensitiveness

Moisture Sensitive

Synonyms & References

English

1-Chloroethyl chlorocarbonate
AKOS000121152
1-Chloroethyl carbonochloridate; 1-Chloroethyl chloroformate; Chloroformic acid 1-chloroethyl ester
a-chloroethylchloroformat
1-chlorethyl chloroformate
alpha-chloroethyl carbonochloridate
1-Chloro ethyl chloroformate
FT-0600868
1-chloroethyl chloroforrnate
1-Chloroethyl chloridocarbonate #
alpha chloroethylchoroformate
1-chlorocarbonyloxy-1-chloroethane
50893-53-3
a-chloro-ethyl chloroformate
Chloroformic Acid 1-Chloroethyl Ester
1-chloroethoxycarbonyl chloride
1-choroethyl chloroformate
J-504527
STR02709
MFCD00000647
1-CHLOROETHYLCHLOROFORMATE
alphachloroethyl chloroformate
1 -chloroethyl chloroformate
AKOS017343084
Carbonochloridic acid, 1-chloroethyl ester
SCHEMBL25559
1-Chloroethyl chloroformate
BP-10597
QOPVNWQGBQYBBP-UHFFFAOYSA-
NS00057844
1-chloroethyl-chloroformate

MDL Number

MFCD00000647

Customs Code

2915900090

FAQ

What is 1-Chloroethyl carbonochloridate (CAS: 50893-53-3)?

1-Chloroethyl carbonochloridate is a chemical compound with the CAS number 50893-53-3. It is a chlorinated acylating agent, typically used in organic synthesis. Its chemical formula is C3H5Cl2O, and it is a colorless liquid with a pungent odor. It is known for its reactivity and ability to participate in various chemical reactions, including nucleophilic substitution.

What are the main uses of 1-Chloroethyl carbonochloridate (CAS: 50893-53-3)?

1-Chloroethyl carbonochloridate is primarily used in pharmaceutical and chemical research as an intermediate for synthesizing organic compounds. It finds applications in the production of certain drugs, as well as in polymer chemistry and other industrial processes. Its utility lies in its ability to form esters and amides under appropriate reaction conditions.

Is 1-Chloroethyl carbonochloridate (CAS: 50893-53-3) safe?

1-Chloroethyl carbonochloridate is considered hazardous due to its potential to cause irritation and toxicity. It should be handled with care in a well-ventilated area, using appropriate personal protective equipment (PPE). Safety standards recommend avoiding prolonged exposure and following proper disposal protocols to ensure environmental and occupational safety.

How should 1-Chloroethyl carbonochloridate (CAS: 50893-53-3) be stored?

1-Chloroethyl carbonochloridate should be stored in a cool, dry, and dark place, away from moisture and incompatible substances. It is best kept in a sealed container at a temperature below 25°C and should be protected from light to maintain stability. Proper storage is essential to prevent degradation and ensure safety during handling.