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3-CHLORO-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE

3-CHLORO-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE structure

CAS No:
17530-69-7
Formula:
C8H11ClO
Chemical Name:
3-CHLORO-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE
Synonyms:
LABOTEST-BB LT01147600;3-CHLORO-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE;3-CHLORO-5,5-DIMETHYLCYCLOHEX-2-EN-1-ONE;3-Chloro-5,5-dimethyl-2-cyclohexenone;5,5-Dimethyl-3-chloro-2-cyclohexen-1-one;5,5-Dimethyl-3-chlorocyclohex-2-enone;NISTC17530697;3-Chloro-5,5-dimethy1-2-cyclohexen-1-one

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3-CHLORO-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE Basic Attributes

Molecular Weight：

158.63

Exact Mass：

158.05000

BRN：

1099253

UNII：

E73W928G5O

DSSTox ID：

DTXSID20169966

HScode：

2914700090

Characteristics

PSA：

17.1

XLogP3：

2.49820

Density：

1,084 g/cm 3

Boiling Point：

44-46°C0,1mm

Flash Point：

44-46°C/0.1mm

Refractive Index：

1.488

Vapor Pressure：

0.131mmHg at 25°C

Safety Information

hazard class code：

36/37/38

safety instructions：

26-37/39

Computed Properties

Molecular Weight:158.62
XLogP3:2.1
Hydrogen Bond Acceptor Count:1
Exact Mass:158.0498427
Monoisotopic Mass:158.0498427
Topological Polar Surface Area:17.1
Heavy Atom Count:10
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-CHLORO-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

3-CHLORO-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE

SDS

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