ChemicalBook--->CAS DataBase List--->589-75-3

589-75-3

589-75-3 Structure

589-75-3 Structure
IdentificationMore
[Name]

BUTYL CAPRYLATE
[CAS]

589-75-3
[Synonyms]

BUTYL CAPRYLATE
BUTYL OCTANOATE
CAPRYLIC ACID N-BUTYL ESTER
N-BUTYL CAPRYLATE
N-BUTYL N-OCTANOATE
N-BUTYL OCTANOATE
N-CAPRYLIC ACID N-BUTYL ESTER
N-OCTANOIC ACID N-BUTYL ESTER
Octanoic acid, butyl ester
Octanoicacid,butylester
octanoicacidbutylester
butyl n-octanoate
n-octanoic acid butyl ester
Butyloctanoat
Caprylic acid butyl ester
[EINECS(EC#)]

209-659-0
[Molecular Formula]

C12H24O2
[MDL Number]

MFCD00048918
[Molecular Weight]

200.32
[MOL File]

589-75-3.mol
Chemical PropertiesBack Directory
[Melting point ]

-42.9°C
[Boiling point ]

245 °C
[density ]

0.86
[refractive index ]

1.4230-1.4260
[Fp ]

124 °C
[storage temp. ]

−20°C
[solubility ]

Insoluble in water, soluble in alcohol and oils
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Odor]

at 100.00 %. butter ether herbal dank
[Odor Type]

buttery
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C12H24O2/c1-3-5-7-8-9-10-12(13)14-11-6-4-2/h3-11H2,1-2H3
[InChIKey]

PSXNDMJWRZYVTM-UHFFFAOYSA-N
[SMILES]

CCCCCCCC(=O)OCCCC
[LogP]

4.861 (est)
[CAS DataBase Reference]

589-75-3(CAS DataBase Reference)
[EPA Substance Registry System]

Butyl octanoate (589-75-3)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

WGK 2
[TSCA ]

TSCA listed
[HS Code ]

2915.60.5000
[Storage Class]

10 - Combustible liquids
Hazard InformationBack Directory
[Uses]

Fruity-green, slightly oily and floral. Refreshing fruity, slightly green taste. Used in flavour compositions for imitation Apple, Cognac, Gooseberry, Wine, Pear, etc.
[Definition]

ChEBI: An octanoate ester obtained by the formal condensation of the carboxy group of octanoic acid with the hydroxy group of butanol.
Spectrum DetailBack Directory
[Spectrum Detail]

BUTYL CAPRYLATE(589-75-3)MS
BUTYL CAPRYLATE(589-75-3)1HNMR
BUTYL CAPRYLATE(589-75-3)13CNMR
BUTYL CAPRYLATE(589-75-3)IR1
BUTYL CAPRYLATE(589-75-3)IR2
BUTYL CAPRYLATE(589-75-3)Raman
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

Butyl n-Octanoate,>99.0%(GC)(589-75-3)
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