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(4-Chlorophenyl)acetone

(4-Chlorophenyl)acetone structure

CAS No:
5586-88-9
Formula:
C9H9ClO
Chemical Name:
(4-Chlorophenyl)acetone
Synonyms:
2-Propanone,1-(4-chlorophenyl)-;2-Propanone,1-(p-chlorophenyl)-;2-Propanone,(p-chlorophenyl)-;1-(4-Chlorophenyl)-2-propanone;(p-Chlorophenyl)acetone;Methyl p-chlorobenzyl ketone;1-(p-Chlorophenyl)-2-propanone;(4-Chlorophenyl)acetone;p-Chlorophenyl-2-propanone;p-Chlorobenzyl methyl ketone;4-Chlorobenzyl methyl ketone;NSC 22985;1-(4-Chlorophenyl)propan-2-one;1-(4-Chlorophenyl)acetone
Categories:
Flavors and Fragrances > Synthetic Fragrances

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Description

clear light yellow liquid

(4-Chlorophenyl)acetone Basic Attributes

Molecular Weight：

168.62

Exact Mass：

168.62

EC Number：

226-986-4

UNII：

I2FE1ERE85

NSC Number：

22985

DSSTox ID：

DTXSID90204459

HScode：

2914700090

Characteristics

PSA：

17.1

XLogP3：

2.5

Appearance：

Clear light yellow Liquid

Density：

1.1397 g/cm³

Melting Point：

6-8 °C

Boiling Point：

85-86 °C @ Press: 1 Torr

Flash Point：

>110℃

Refractive Index：

1.526

Safety Information

hazard class code：

22-52

safety instructions：

24/25

Marks：

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

(4-Chlorophenyl)acetone Use and Manufacturing

4-Chlorophenylacetone is a phenylacetone derivative used in the preparation of biologically active compounds such as anorectic agents.

Computed Properties

Molecular Weight:168.62
XLogP3:2.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:168.0341926
Monoisotopic Mass:168.0341926
Topological Polar Surface Area:17.1
Heavy Atom Count:11
Complexity:137
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (4-Chlorophenyl)acetone

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

(4-Chlorophenyl)acetone

SDS

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