Methyl 4-(chloromethyl)benzoate

Basic Information

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CAS Number

34040-64-7

Molecular Formula

C9H9ClO2

Molecular Weight

184.62 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

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

37.0 to 41.0 deg-C

Boiling Point

165°C/30mmHg

Flash Point

160-165°C/30mm

SMILES

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COC(=O)C1=CC=C(C=C1)CCl

InChI

InChI=1S/C9H9ClO2/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,6H2,1H3

InChIKey

SATDLKYRVXFXRE-UHFFFAOYSA-N

LogP

2.2119999999999997

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

151

Safety Information

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Hazard Statement

H290 May be corrosive to metals
Corrosive to Metals

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

Hazard Class

Class 8 Class 8

Synonyms & References

English

Methyl alpha-chloro-p-toluate
34040-64-7
p-(Methoxycarbonyl)benzyl chloride
Methyl4-(chloromethyl)benzoate
Methyl a-chloro-p-toluate
p-Carbomethoxybenzyl chloride
FT-0628630
F11973
F8881-2581
4SJE6GWW8F
p-chloromethylbenzoic acid methyl ester
p-Toluic acid, .alpha.-chloro-, methyl ester
4-Chloromethylbenzoic acid methyl ester
4-chloromethyl-benzoic acid methyl ester
4-methoxycarbonylbenzyl chloride
C1763
Benzoic acid, 4-(chloromethyl)-, methyl ester
Methyl p-(chloromethyl)benzoate
AKOS000261555
alpha-Chloro-p-toluic Acid Methyl Ester
methyl 4-(chloromethyl)-benzoate
4-(Chloromethyl)benzoic acid methyl ester
SCHEMBL200
methyl-4-(chloromethyl)benzoate
Methyl .alpha.-chloro-p-toluate
4-(Methoxycarbonyl)benzyl chloride
NS00029602
AC-13472
4-carbomethoxybenzyl chloride
methyl-4-(chloromethyl) benzoate
CS-W007896

MDL Number

MFCD00511224

Customs Code

2916399090

FAQ

What are the physical and chemical properties of Methyl 4-(chloromethyl)benzoate (CAS: 34040-64-7)?

Methyl 4-(chloromethyl)benzoate (CAS: 34040-64-7) is a white crystalline solid with a molecular weight of 192.58 g/mol. It has a melting point of 67-69°C and is slightly soluble in water. The compound is reactive towards nucleophiles and bases. It is used in various chemical reactions and syntheses due to its functional groups.

How is Methyl 4-(chloromethyl)benzoate (CAS: 34040-64-7) typically synthesized?

Methyl 4-(chloromethyl)benzoate is typically synthesized by reacting methyl chloroformate with benzoic acid or its derivatives. The reaction is usually performed in the presence of a base such as pyridine. The product can be isolated by recrystallization and has a good yield of up to 90%. This process is selective and efficient for industrial applications.

What industries use Methyl 4-(chloromethyl)benzoate (CAS: 34040-64-7)?

Methyl 4-(chloromethyl)benzoate (CAS: 34040-64-7) is widely used in the pharmaceutical, polymer, and chemical industries. It serves as a building block in the synthesis of other compounds and is also used in the production of certain polymers and in chemical sensors. Its applications include drug intermediates and materials science.

What precautions should be taken when handling Methyl 4-(chloromethyl)benzoate (CAS: 34040-64-7)?

When handling Methyl 4-(chloromethyl)benzoate (CAS: 34040-64-7), it is important to wear appropriate personal protective equipment (PPE) such as gloves and safety goggles. Work should be conducted in a well-ventilated area or a fume hood. In case of a spill, avoid inhalation and contact with skin. Refer to the Safety Data Sheet (SDS) for specific handling and disposal guidelines.