ChemicalBook--->CAS DataBase List--->13074-65-2

13074-65-2

13074-65-2 Structure

13074-65-2 Structure
IdentificationMore
[Name]

2-N-HEXYLCYCLOPENTANONE
[CAS]

13074-65-2
[Synonyms]

2-HEXYLCYCLOPENTANONE
2-N-HEXYLCYCLOPENTANONE
JASMATONE
2-hexyl-cyclopentanon
hexylcyclopentanone
2-hexylcyclopentan-1-one
Cyclopentanone, 2-hexyl-
2-Hexylcyclopentan-1-on
2-Hexyl-1-cyclopentanone
[EINECS(EC#)]

235-970-6
[Molecular Formula]

C11H20O
[MDL Number]

MFCD00059516
[Molecular Weight]

168.28
[MOL File]

13074-65-2.mol
Chemical PropertiesBack Directory
[Boiling point ]

108-110°C 10mm
[density ]

0,89 g/cm3
[vapor pressure ]

2.1Pa at 20℃
[refractive index ]

1.4495
[Fp ]

112°C
[storage temp. ]

2-8°C
[Odor]

at 100.00 %. mild jasmin fruity
[Odor Type]

floral
[Water Solubility ]

59.5mg/L at 20℃
[BRN ]

2041950
[Cosmetics Ingredients Functions]

PERFUMING
[LogP]

3.9
[CAS DataBase Reference]

13074-65-2(CAS DataBase Reference)
[EPA Substance Registry System]

Cyclopentanone, 2-hexyl- (13074-65-2)
Questions And AnswerBack Directory
[Uses]

2-Hexylcyclopentanone is an organic intermediate that can be prepared in one step from cyclohexanone and 1-hexene. Literature reports that 2-Hexylcyclopentanone can be used to prepare delta-undecylactone.
Safety DataBack Directory
[RTECS ]

GY4972000
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

2914290090
Hazard InformationBack Directory
[Description]

2-N-hexylcyclopentanone is less spicy or Celery-like than Jasmone, more sharp-fruity or green, and not quite as powerful. Rather than considering it as a lowcost substitute for Jasmone, it would be better to use it as an individual fragrance material with effects of its own. It will lend considerable floral-herbaceous power to fragrances other than the typical floral ones, and itmay participate in giving Jasmin effect when blended with suitable components.
[Preparation]

2-N-hexylcyclopentanone is prepared:
1) by condensation of Hexaldehyde and CycIopentanone, followed by hydrogenation of the condensation product.
2) by hydrogenation of the reaction mixture from Lactonization of Undecylenic acid with Phosphoric or Polyphosphoric acid.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 98, p. 248, 1976 DOI: 10.1021/ja00417a048
Spectrum DetailBack Directory
[Spectrum Detail]

2-N-HEXYLCYCLOPENTANONE(13074-65-2)1HNMR
2-N-HEXYLCYCLOPENTANONE(13074-65-2)IR1
2-N-HEXYLCYCLOPENTANONE(13074-65-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2-n-Hexylcyclopentanone, 98%(13074-65-2)
[TCI AMERICA]

2-Hexylcyclopentanone,>96.0%(GC)(13074-65-2)
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