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5-Methyl-3-hexanone

5-Methyl-3-hexanone structure

CAS No:
623-56-3
Formula:
C7H14O
Chemical Name:
5-Methyl-3-hexanone
Synonyms:
3-Hexanone,5-methyl-;5-Methyl-3-hexanone;Ethyl isobutyl ketone;Isobutyl ethyl ketone;2-Methyl-4-hexanone

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Description

clear liquid with acetone-like odor

Liquid

Ethyl isobutyl ketone is a ketone.

5-Methyl-3-hexanone Basic Attributes

Molecular Weight：

114.19

Exact Mass：

114.19

EC Number：

210-801-9

UNII：

884FC3YC2Q

DSSTox ID：

DTXSID90211360

HScode：

2914190090

Characteristics

PSA：

17.1

XLogP3：

2.01160

Appearance：

Liquid

Density：

0.8090 g/cm³ @ Temp: 20 °C

Melting Point：

-46.2°C (estimate)

Boiling Point：

135 °C

Flash Point：

39°C

Refractive Index：

1.401

Safety Information

Hazard category：

Transport codes：

1224

hazard class code：

safety instructions：

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, P501

Hazard Statements：

H226

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory.

5-Methyl-3-hexanone Use and Manufacturing

Use Classification：

Fatty Acyls [FA] -> Oxygenated hydrocarbons [FA12]

Computed Properties

Molecular Weight:114.19
XLogP3:1.7
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:114.104465066
Monoisotopic Mass:114.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:8
Complexity:74.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Methyl-3-hexanone

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

5-Methyl-3-hexanone

SDS

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