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3,5,5-Trimethyl-1,2-cyclohexanedione

3,5,5-Trimethyl-1,2-cyclohexanedione structure

CAS No:
57696-89-6
Formula:
C9H14O2
Chemical Name:
3,5,5-Trimethyl-1,2-cyclohexanedione
Synonyms:
1,2-Cyclohexanedione,3,5,5-trimethyl-;3,5,5-Trimethyl-1,2-cyclohexanedione;3,5,5-Trimethylcyclohexane-1,2-dione
Categories:
Flavors and Fragrances > Synthetic Fragrances

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Description

3,5,5-Trimethyl-1,2-cyclohexanedione is a cyclic ketone.

3,5,5-Trimethyl-1,2-cyclohexanedione Basic Attributes

Molecular Weight：

154.21

Exact Mass：

154.21

EC Number：

1312995-182-4

HScode：

38220090

Characteristics

PSA：

34.1

XLogP3：

1.4

Appearance：

colorless to pale yellow liquid

Density：

1.0±0.1 g/cm3

Melting Point：

91 °C

Boiling Point：

214.6°C at 760 mmHg

Flash Point：

>100°(212°F)

Refractive Index：

1.444

Safety Information

hazard class code：

36/38

safety instructions：

36-26

Precautionary statement(s)：

P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P333+P313, P337+P313, P363, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (61.29%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P333+P313, P337+P313, P363, and P501|Aggregated GHS information provided by 63 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

3,5,5-Trimethyl-1,2-cyclohexanedione Use and Manufacturing

Uses

Suitable for the flavoring or addition of flue-cured and mixed cigarettes

Manufacturing Info：

1,2-Cyclohexanedione, 3,5,5-trimethyl-: INACTIVE

Computed Properties

Molecular Weight:154.21
XLogP3:1.4
Hydrogen Bond Acceptor Count:2
Exact Mass:154.099379685
Monoisotopic Mass:154.099379685
Topological Polar Surface Area:34.1
Heavy Atom Count:11
Complexity:204
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 3,5,5-Trimethyl-1,2-cyclohexanedione

Hangzhou KieRay Chem Co.,LTD Contact Supplier

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3,5,5-Trimethylcyclohexane-1,2-dione

CAS No.: 57696-89-6

Grade: industrial Grade

Content: 98%

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Greenbo Biochem Contact Supplier

CN
YRS

Business licensed Certified factory

Manufactory Supplier of Active Pharm Ingredients,Chemical Catalyst,Pharmaceutical Intermediates,Flavors and Fragrances,Agrochemicals,Chemical Pesticides,Organic Intermediates,OLED Intermediates

3,5,5-Trimethylcyclohexane-1,2-dione 99% high purity certified Professional producer Greenbo

CAS No.: 57696-89-6

Grade: Food Grade

Content: 99%

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Guide of 3,5,5-Trimethyl-1,2-cyclohexanedione

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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3,5,5-Trimethyl-1,2-cyclohexanedione

SDS

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