1-chloro-3-vinylbenzene

Basic Information

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CAS Number

2039-85-2

Molecular Formula

C8H7Cl

Molecular Weight

138.6 g/mol

Chemical Classification

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

-23.4°C (estimate)

Boiling Point

87°C/25mmHg

Water Solubility

Not miscible or difficult to mix in water. Soluble in ether, and ethanol

Flash Point

62 ºC

Refractive Index

1.5603-1.5623

SMILES

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C=CC1=CC(=CC=C1)Cl

InChI

InChI=1S/C8H7Cl/c1-2-7-4-3-5-8(9)6-7/h2-6H,1H2

InChIKey

BOVQCIDBZXNFEJ-UHFFFAOYSA-N

LogP

2.9830000000000014

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

98.7

Safety Information

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GHS Hazard Pictograms

H302

H332

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H332 Harmful if inhaled
Acute toxicity, inhalation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

3-chloro-styrene
NSC18602
UNII-11K8G759HC
Benzene, 1-chloro-3-ethenyl-
DTXSID8073130
meta-chlorostyrene
3-Chlorostyrene, 98%, contains 0.1% 3,5-di-tert-butylcatechol as stabilizer
1-chloro-3-ethenylbenzene
NSC 18602
EINECS 218-024-7
SCHEMBL9925569
3-CHLOROSTYRENE [HSDB]
1-Chloro-3-vinylbenzene
SCHEMBL181443
2039-85-2
3-Chlorostyrene
11K8G759HC
M-CHLOROSTYRENE
SY017095
3-Chlorostyrene, 96%, contains 0.1% TBC as stabilizer
1-Chloro-3-vinylbenzene #
AKOS009157282
A4440
3-chlorophenylethene
J-013278
3-Chlorostyrene (stabilized with TBC)
Styrene, m-chloro-
CS-W011046
HSDB 3452
NS00026616
MFCD00000598

MDL Number

MFCD00000598

Customs Code

2903999090

FAQ

What is 1-chloro-3-vinylbenzene (CAS: 2039-85-2)?

1-Chloro-3-vinylbenzene (CAS: 2039-85-2) is an organic compound with the molecular formula C9H8Cl. It is a derivatives of benzene with a vinyl group and a chlorine substituent. This compound is colorless to yellowish liquid with a characteristic odor. It is used in the synthesis of various organic compounds and is an intermediate in the preparation of dyes and pharmaceuticals.

What are the main uses of 1-chloro-3-vinylbenzene (CAS: 2039-85-2)?

1-Chloro-3-vinylbenzene (CAS: 2039-85-2) is primarily used as an intermediate in the chemical industry. It serves as a building block for the synthesis of dyes, pharmaceuticals, and other organic compounds. Additionally, it is used in the preparation of certain rubber chemicals and plasticizers.

Is 1-chloro-3-vinylbenzene (CAS: 2039-85-2) safe?

1-Chloro-3-vinylbenzene (CAS: 2039-85-2) can be safe when handled with appropriate precautions. It is classified as a moderately toxic compound and exposure to its vapors can cause irritation to the eyes and respiratory system. Personal protective equipment such as gloves, goggles, and a respirator are recommended. Adequate ventilation is essential during handling and storage.

How should 1-chloro-3-vinylbenzene (CAS: 2039-85-2) be stored?

1-Chloro-3-vinylbenzene (CAS: 2039-85-2) should be stored in a cool, well-ventilated area away from direct sunlight and heat sources. It should be kept in tightly sealed containers made of suitable materials like stainless steel or glass. The storage temperature should not exceed 25°C, and the relative humidity should be kept below 60%. It is important to avoid contact with oxidizers and strong acids.