Acetic acid, 2-chloro-, phenylmethyl ester

Basic Information

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CAS Number

140-18-1

Molecular Formula

C9H9ClO2

Molecular Weight

184.62 g/mol

EINECS

205-400-0

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

Boiling Point

90 °C/1 mmHg

Density

1.215 g/mL at 25 °C

Refractive Index

n20/D 1.525(lit.)

SMILES

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

InChI

InChI=1S/C9H9ClO2/c10-6-9(11)12-7-8-4-2-1-3-5-8/h1-5H,6-7H2

InChIKey

SOGXBRHOWDEKQB-UHFFFAOYSA-N

LogP

1.9686000000000001

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

142

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

Storage Conditions

under inert gas (nitrogen or Argon) at 2-8°C

Toxicity

LDLo ipr-mus: 500 mg/kg CBCCT* 8,99,56

RTECS

AF8750000

Synonyms & References

English

PHENYLMETHYL CHLOROACETATE
CS-0171366
Acetic acid, chloro-, phenylmethyl ester
Benzyl-alpha-chloroacetate
SCHEMBL138306
A807628
AI3-18343
InChI=1/C9H9ClO2/c10-6-9(11)12-7-8-4-2-1-3-5-8/h1-5H,6-7H2
phenylmethyl 2-chloroacetate
BRN 2091502
NS00024542
B52EJ32AB5
WLN: G1VO1R
4-06-00-02264 (Beilstein Handbook Reference)
Benzyl monochloracetate
Acetic acid, 2-chloro-, phenylmethyl ester
benzyl monochloroacetate
UNII-B52EJ32AB5
AC-16894
SY010939
FT-0622816
DTXSID8059689
AS-65381
MFCD00157062
NSC8061
140-18-1
Benzyl chloroacetate, 99%
Chloroacetic acid, benzyl ester
EINECS 205-400-0
chloro-acetic acid benzyl ester
NSC-8061

MDL Number

MFCD00157062

EC Number

205-400-0

Customs Code

2915400090

FAQ

What is Acetic acid, 2-chloro-, phenylmethyl ester (CAS: 140-18-1)?

Acetic acid, 2-chloro-, phenylmethyl ester (CAS: 140-18-1) is an organic compound used in various industrial and research applications. It is a colorless, oily liquid with a pungent odor.

What are the main uses of Acetic acid, 2-chloro-, phenylmethyl ester (CAS: 140-18-1)?

Acetic acid, 2-chloro-, phenylmethyl ester (CAS: 140-18-1) is primarily used in pharmaceuticals as a raw material for the synthesis of other compounds. It is also utilized in the preparation of dyes, pigments, and as a reagent in organic synthesis.

Is Acetic acid, 2-chloro-, phenylmethyl ester (CAS: 140-18-1) safe?

Acetic acid, 2-chloro-, phenylmethyl ester (CAS: 140-18-1) can be hazardous due to its irritant and toxic nature. Proper safety measures, including wearing protective clothing and using appropriate ventilation, are essential during handling.

How should Acetic acid, 2-chloro-, phenylmethyl ester (CAS: 140-18-1) be stored?

Acetic acid, 2-chloro-, phenylmethyl ester (CAS: 140-18-1) should be stored in tightly sealed containers at room temperature away from heat and direct sunlight. Adequate ventilation and fire protection measures are necessary to prevent polymerization and decomposition.