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1-Vinylbutanol

1-Vinylbutanol structure

1-Vinylbutanol 

structure
  • CAS No:

    4798-44-1

  • Formula:

    C6H12O

  • Chemical Name:

    1-Vinylbutanol

  • Synonyms:

    1-Hexen-3-ol;Propylvinylcarbinol;3-Hydroxy-1-hexene;1-Vinylbutanol;(±)-1-Hexen-3-ol;1-Propylallyl alcohol;NSC 89701;67928-93-2

  • Categories:

    Cosmetic Ingredient  >  Perfuming

Description

CLEAR COLORLESS TO VERY SLIGHTLY YELLOW LIQUID 1-Hexen-3-ol has a meat-like odor


Clear, colourless liquid; meat-like


1-Hexen-3-ol is a secondary alcohol.

1-Vinylbutanol Basic Attributes

100.161

100.16

225-355-0

89701

DTXSID1022219

Characteristics

20.2

1.58

Clear, colourless liquid; meat-like

0.834 g/cm3 @ Temp: 22 °C

-15ºC

134 °C

35.0±0.0 °C

1.429

H2O: INsoluble

Keep away from sources of ignition. Store in a cool, dry place. Store in a tightly closed container. Flammables-area.

Safety Information

III

3

UN 1987 3/PG 3

3

R10

S16-S29-S33

Stable under normal temperatures and pressures.

P210-P403 + P235

H226

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 302 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1-Vinylbutanol Use and Manufacturing

Uses

Flavoring Agents -> JECFA Flavorings Index

1-Hexen-3-ol: ACTIVE

Food additives -> Flavoring Agents

Flavoring Agents

Computed Properties

Molecular Weight:100.16
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:100.088815002
Monoisotopic Mass:100.088815002
Topological Polar Surface Area:20.2
Heavy Atom Count:7
Complexity:50.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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