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Phenylmethyl 2-chloroacetate

Phenylmethyl 2-chloroacetate structure

CAS No:
140-18-1
Formula:
C9H9ClO2
Chemical Name:
Phenylmethyl 2-chloroacetate
Synonyms:
Acetic acid,2-chloro-,phenylmethyl ester;Acetic acid,chloro-,benzyl ester;Acetic acid,chloro-,phenylmethyl ester;Phenylmethyl 2-chloroacetate;Benzyl chloroacetate;Benzyl α-chloroacetate;Chloroacetic acid benzyl ester;NSC 8061;Benzyl 2-chloroacetate
Categories:
Organic Chemistry > Nitrogen Compounds

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Phenylmethyl 2-chloroacetate Basic Attributes

Molecular Weight：

184.62

Exact Mass：

184.62

EC Number：

205-400-0

NSC Number：

8061

DSSTox ID：

DTXSID8059689

HScode：

2915400090

Characteristics

PSA：

26.3

XLogP3：

2.20

Appearance：

Colorless liquid.

Density：

1.2±0.1 g/cm3

Melting Point：

90ºC

Boiling Point：

132 °C @ Press: 12 Torr

Flash Point：

>230 °F

Refractive Index：

1.525

Water Solubility：

H2O: insoluble

Storage Conditions：

Store in a cool, dry place. Store in a tightly closed container.

Vapor Pressure：

0.0189mmHg at 25°C

Toxicity：

Abdominal cavity-mouse LDL0: 500 mg/kg

Flammability characteristics：

Flammable; burning produces toxic chloride fumes

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36-37/39

RTECS Number：

AF8750000

Marks：

Storage features：

Ventilated, low temperature and dry

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 41 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Toxicity

Toxicity class：

moderately toxic

Phenylmethyl 2-chloroacetate Use and Manufacturing

Manufacturing Info：

Acetic acid, 2-chloro-, phenylmethyl ester: INACTIVE

Computed Properties

Molecular Weight:184.62
XLogP3:2.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:184.0291072
Monoisotopic Mass:184.0291072
Topological Polar Surface Area:26.3
Heavy Atom Count:12
Complexity:142
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Benzylamine

Benzyl alcohol

Pyridine

Sodium sulfate

Chloroacetic acid

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CAS No.: 140-18-1

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Guide of Phenylmethyl 2-chloroacetate

Basic Attributes
Characteristics
Safety Information
Toxicity
Use and Manufacturing
Computed Properties
Material
Recommended Suppliers
Latest News
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Phenylmethyl 2-chloroacetate

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