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4,4-DIMETHYL-2-CYCLOHEXEN-1-ONE

4,4-DIMETHYL-2-CYCLOHEXEN-1-ONE structure

CAS No:
1073-13-8
Formula:
C8H12O
Chemical Name:
4,4-DIMETHYL-2-CYCLOHEXEN-1-ONE
Synonyms:
4,4-Dimethylcyclohexenone;4,4-Dimethyl-2-cyclohexenone;4,4-Dimethylcyclohex-2-enone;6,6-Dimethylcyclohexen-3-one;6,6-Dimethylcyclohexene-3-one;3,3-Dimethylcyclohexene-6-one;4,4-DIMETHYL-2-CYCLOHEXEN-1-ONE;4,4-Dimethylcyclohex-2-en-1-one;4,4-Dimethylcyclohex-1-en-2-one;4,4-DIMETHYL-2-CYCLOHEXENE-1-ONE
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

CLEAR DARK BROWN LIQUID

4,4-DIMETHYL-2-CYCLOHEXEN-1-ONE Basic Attributes

Molecular Weight：

124.18

Exact Mass：

124.088814

UNII：

10J1HF864Z

DSSTox ID：

DTXSID70147996

HScode：

29142990

Characteristics

PSA：

17.1

XLogP3：

1.8

Appearance：

CLEAR DARK BROWN LIQUID

Density：

0.944 g/mL at 25 °C(lit.)

Boiling Point：

72-73.5 °C20 mm Hg(lit.)

Flash Point：

148 °F

Refractive Index：

n 20/D 1.473(lit.)

Vapor Pressure：

1.26mmHg at 25°C

Safety Information

wgk germany：

hazard class code：

R36

safety instructions：

36/37/39-26

Marks：

Xn,Xi

Precautionary statement(s)：

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

Hazard Statements：

H315

GHS Classification：

|Warning|H227 (16.67%): Combustible liquid [Warning Flammable liquids]|P210, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:124.18
XLogP3:1.8
Hydrogen Bond Acceptor Count:1
Exact Mass:124.088815002
Monoisotopic Mass:124.088815002
Topological Polar Surface Area:17.1
Heavy Atom Count:9
Complexity:154
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4,4-DIMETHYL-2-CYCLOHEXEN-1-ONE

CAS No.: 1073-13-8

Content: 99.00%

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Guide of 4,4-DIMETHYL-2-CYCLOHEXEN-1-ONE

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Basic Attributes
Characteristics
Safety Information
Computed Properties
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