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3-Methyl-4-heptanone

3-Methyl-4-heptanone structure

CAS No:
15726-15-5
Formula:
C8H16O
Chemical Name:
3-Methyl-4-heptanone
Synonyms:
4-Heptanone,3-methyl-;3-Methyl-4-heptanone;sec-Butyl propyl ketone

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3-Methyl-4-heptanone Basic Attributes

Molecular Weight：

128.21

Exact Mass：

128.21

EC Number：

239-820-0

Characteristics

PSA：

17.1 Å²

Density：

0.817 g/cm³ @ Temp: 20 °C

Melting Point：

-32.24°C (estimate)

Boiling Point：

154 °C

Refractive Index：

1.4100 to 1.4130

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 1224 3/PG III

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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

3-Methyl-4-heptanone Use and Manufacturing

Use Classification：

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

Computed Properties

Molecular Weight:128.21
XLogP3:2.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:128.120115130
Monoisotopic Mass:128.120115130
Topological Polar Surface Area:17.1
Heavy Atom Count:9
Complexity:86.6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3-METHYL-4-HEPTANONE

CAS No.: 15726-15-5

Content: 99.00%

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Guide of 3-Methyl-4-heptanone

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers

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