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Citronellyl phenylacetate

Citronellyl phenylacetate structure

Citronellyl phenylacetate 

structure
  • CAS No:

    139-70-8

  • Formula:

    C18H26O2

  • Chemical Name:

    Citronellyl phenylacetate

  • Synonyms:

    Benzeneacetic acid,3,7-dimethyl-6-octen-1-yl ester;Acetic acid,phenyl-,3,7-dimethyl-6-octenyl ester;Benzeneacetic acid,3,7-dimethyl-6-octenyl ester;6-Octen-1-ol,3,7-dimethyl-,phenylacetate;Citronellyl phenylacetate;Phenylacetic acid,3,7-dimethyl-6-octenyl ester

  • Categories:

    Cosmetic Ingredient  >  Perfuming

Description

Colourless, somewhat viscous liquid; sweet-herbaceous-rosy, yet heavy and very tenacious odour, reminiscent of the petals of roses

Citronellyl phenylacetate Basic Attributes

274.39800

274.40

205-373-5

Characteristics

26.30000

4.54490

LIQUID

0.964 g/cm3

374.3ºC at 760 mmHg

121.2ºC

1.5

0.07646 mg/L @ 25 °C (est)|Insoluble in water; soluble in oils|Miscible at room temperature (in ethanol)

8.44E-06mmHg at 25°C

Citronellyl phenylacetate Use and Manufacturing

Benzeneacetic acid, 3,7-dimethyl-6-octen-1-yl ester: ACTIVE

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

Flavoring Agents

Computed Properties

Molecular Weight:274.4
XLogP3:5.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:9
Exact Mass:274.193280068
Monoisotopic Mass:274.193280068
Topological Polar Surface Area:26.3
Heavy Atom Count:20
Complexity:297
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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