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1,3-Nonanediol acetate

1,3-Nonanediol acetate structure

1,3-Nonanediol acetate 

structure
  • CAS No:

    1322-17-4

  • Formula:

    C11H22O3

  • Chemical Name:

    1,3-Nonanediol acetate

  • Synonyms:

    1,3-Nonanediol,monoacetate;1,3-Nonanediol acetate

  • Categories:

    Cosmetic Ingredient  >  Perfuming

Description

colourless to pale yellow, slightly oily liquid with floral odour similar to jasmine


3-hydroxynonyl acetate is an acetate ester resulting from the formal condensation of the carboxy group of acetic acid with 1-hydroxy group of nonane-1,3-diol. It is a secondary alcohol and an acetate ester.

1,3-Nonanediol acetate Basic Attributes

202.29

202.156891

215-332-3

33721

DTXSID1047657

Characteristics

46.53000

2.77

colourless to pale yellow, slightly oily liquid with floral odour similar to jasmine

1.0±0.1 g/cm3

265 °C(lit.)

230 °F

1.445

slightly soluble in water; soluble in alcohol and oils

0.00362mmHg at 25°C

Safety Information

2

1,3-Nonanediol acetate Use and Manufacturing

Methods of Manufacturing

Synthesis using 1-octene as starting material.

Uses

Jasmine flavor for cosmetics and soap

1,3-Nonanediol, monoacetate: ACTIVE

Food additives -> Flavoring Agents|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]

Flavoring Agents

Computed Properties

Molecular Weight:202.29
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:202.15689456
Monoisotopic Mass:202.15689456
Topological Polar Surface Area:46.5
Heavy Atom Count:14
Complexity:146
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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