3-Chloropropyl acetate

Basic Information

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CAS Number

628-09-1

Molecular Formula

C5H9ClO2

Molecular Weight

136.58 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Boiling Point

80-81 °C/30 mmHg

Density

1.111 g/mL at 25 °C

Water Solubility

Soluble in water (partly).

Refractive Index

n20/D 1.429(lit.)

SMILES

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CC(=O)OCCCCl

InChI

InChI=1S/C5H9ClO2/c1-5(7)8-4-2-3-6/h2-4H2,1H3

InChIKey

KPOHQIPNNIMWRL-UHFFFAOYSA-N

LogP

1.1784

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

72.8

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

NS00035173
3-Chloropropanol acetate
3-Chlorprop-1-ylacetat [German]
BRN 1745110
A834008
1-PROPANOL, 3-CHLORO-, ACETATE
3-Chloropropyl acetate
AS-17283
3-chloropropyl acetate;1-Acetoxy-3-chloropropane
SCHEMBL408956
MFCD00001000
FT-0652240
gamma-Chloropropyl acetate
3-CHLORO-PROPYL ACETATE
DTXSID80211879
3-Chloropropyl acetate, 98%
acetic acid 3-chloro-propyl ester
AKOS006221245
CS-W017752
628-09-1
SY106444
3-Chlorprop-1-ylacetat
.gamma.-Chloropropyl acetate
3-CHLOROPROPYLACETATE
1-acetoxy-3-chloropropane
4-02-00-00140 (Beilstein Handbook Reference)
1-Acetoxy-3-Chloropropane
1-Acetoxy
1-PROPANOL,3-CHLORO-,ACETATE
3-chloro-1-propanol acetate
3-Chloro-1-propyl acetate

MDL Number

MFCD00001000

Customs Code

2915390090

FAQ

What regulatory guidelines apply to 3-Chloropropyl acetate (CAS: 628-09-1)?

3-Chloropropyl acetate (CAS: 628-09-1) is classified under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) as a Hazard Category 2 for Acute Toxicity. Regulatory guidelines under REACH in the European Union require manufacturers and importers to register the substance if the annual tonnage exceeds 1 ton. FDA and EPA have specific requirements for the use and disposal of this compound in the U.S., including documentation of handling and disposal procedures.

Are there alternatives to 3-Chloropropyl acetate (CAS: 628-09-1) in synthesis?

In synthesis, 3-Chloropropyl acetate (CAS: 628-09-1) can be replaced by other acyl chlorides such as propionyl chloride. Other alternatives include using isomers like 2-chloropropyl acetate, or utilizing different functional groups to achieve similar chemical properties. The choice of alternative depends on the specific reaction conditions and desired product properties.

What is the market or research trend for 3-Chloropropyl acetate (CAS: 628-09-1)?

The market for 3-Chloropropyl acetate (CAS: 628-09-1) shows steady growth due to its use in the production of fragrances, solvents, and personal care products. Research trends are focused on developing more environmentally friendly alternatives and exploring its applications in biodegradable materials and pharmaceuticals. The compound's market is expected to expand as industries emphasize sustainability and regulatory compliance.

How should waste containing 3-Chloropropyl acetate (CAS: 628-09-1) be handled?

Waste containing 3-Chloropropyl acetate (CAS: 628-09-1) should be collected in properly labeled containers and stored in a well-ventilated area away from heat and ignition sources. Incineration is a common method for disposal, but it must be conducted by a licensed facility. Professional waste disposal services are recommended to ensure compliance with local and international regulations. Always follow the relevant guidelines for hazardous waste management and disposal.