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1-(2,6-Dichlorophenyl)ethanone

1-(2,6-Dichlorophenyl)ethanone structure

CAS No:
2040-05-3
Formula:
C8H6Cl2O
Chemical Name:
1-(2,6-Dichlorophenyl)ethanone
Synonyms:
Ethanone,1-(2,6-dichlorophenyl)-;Acetophenone,2′,6′-dichloro-;1-(2,6-Dichlorophenyl)ethanone;2′,6′-Dichloroacetophenone;1-(2,6-Dichlorophenyl)ethan-1-one
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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1-(2,6-Dichlorophenyl)ethanone Basic Attributes

Molecular Weight：

189.039

Exact Mass：

189.04

EC Number：

218-035-7

UNII：

2Y6GD4KRT7

DSSTox ID：

DTXSID70174348

HScode：

2914700090

Characteristics

PSA：

17.07000

XLogP3：

2.9

Appearance：

crystal

Density：

1.3±0.1 g/cm3

Melting Point：

42-43 °C

Boiling Point：

140-141 °C @ Press: 24 Torr

Flash Point：

82.2±22.3 °C

Refractive Index：

1.549

Water Solubility：

Insoluble in water.

Vapor Pressure：

0.219mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S26-S36

Marks：

Xi:Irritant;

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 134 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:189.04
XLogP3:2.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:187.9795702
Monoisotopic Mass:187.9795702
Topological Polar Surface Area:17.1
Heavy Atom Count:11
Complexity:148
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2,6-Dichloroacetophenone

CAS No.: 2040-05-3

Content: 99.00%

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CAS No.: 2040-05-3

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Guide of 1-(2,6-Dichlorophenyl)ethanone

Basic Attributes
Characteristics
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Computed Properties
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