ChemicalBook--->CAS DataBase List--->7540-53-6

7540-53-6

7540-53-6 Structure

7540-53-6 Structure
IdentificationBack Directory
[Name]

CITRONELLYL VALERATE
[CAS]

7540-53-6
[Synonyms]

FEMA 2317
CITRONELLYL VALERATE
Citronellyl pentanoate
CITRONELLYL VALERATE 85+%
citronellyl valerate USP/EP/BP
3,7-dimethyloct-6-enyl valerate
3,7-dimethyloct-6-enyl pentanoate
3,7-DIMETHYL-6-OCTEN-1-YL VALERATE
Pentanoicacid,3,7-dimethyl-6-octenylester
Valeric acid 3,7-dimethyl-6-octen-1-yl ester
Pentanoic acid 3,7-dimethyl-6-octen-1-yl ester
citronellylvalerate,3,7-dimethyl-6-octen-1-ylpentanoate
[EINECS(EC#)]

231-416-2
[Molecular Formula]

C15H28O2
[MDL Number]

MFCD00036548
[MOL File]

7540-53-6.mol
[Molecular Weight]

240.38
Chemical PropertiesBack Directory
[Boiling point ]

237 °C(lit.)
[density ]

0.88 g/mL at 25 °C(lit.)
[FEMA ]

2317 | CITRONELLYL VALERATE
[refractive index ]

n20/D 1.445(lit.)
[Fp ]

>230 °F
[Odor]

at 100.00 %. rose herbal honey
[Odor Type]

floral
[JECFA Number]

69
[LogP]

5.87
[EPA Substance Registry System]

Pentanoic acid, 3,7-dimethyl-6-octenyl ester (7540-53-6)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[TSCA ]

TSCA listed
Hazard InformationBack Directory
[Chemical Properties]

Citronellyl valerate has a characteristic rose-, herb-, honey-like odor.
[Occurrence]

Reported in the essence of Boronia citriodora.
[Uses]

Citronellyl valerate is used in perfume compositions as a modifier with lower esters of Citronellol. Also in support of Benzyl valerate, Linalyl-valerate, etc. in honeylike or tobaccolike notes. It seems to introdua more herbaceous-rosy notes than floral notes.
[Definition]

ChEBI: Citronellyl pentanoate is a carboxylic ester.
[Preparation]

Citronellyl valerate is produced by direct esterification of Citronellol with n-Valerie acid under azeotropic conditions.
[Solubility in organics]

Citronellyl valerate is almost insoluble in Propylene glycol, solubie in alcohol, miscible with perfume oils and most flavor materials.
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