ChemicalBook--->CAS DataBase List--->16491-54-6

16491-54-6

16491-54-6 Structure

16491-54-6 Structure
IdentificationBack Directory
[Name]

1-OCTEN-3-YL BUTYRATE
[CAS]

16491-54-6
[Synonyms]

FEMA 3612
EINECS 240-555-8
1-octene-3-butyrate
1-octen-3-olbutyrate
1-pentylallylbutyrate
1-OCTEN-3-YL BUTYRATE
l-Octen-3-yl butyrate
1-OCTEN-3-YLBUTYRATEFCC
oct-1-en-3-yl butanoate
1-Caprylene-yl butyrate
Amylvinylcarbinyl butyrate
butyricacid,1-vinylhexylester
Butyric acid 1-octen-3-yl ester
1-OCTEN-3-YL BUTYRATE USP/EP/BP
butanoicacid,1-ethenylhexylester
1-OCTEN-3-YL BUTYRATE 97+% FCC
Butyric acid 1-ethenylhexyl ester
Butanoic acid 1-octen-3-yl ester
1-Octen-3-yl butyrate >=97%, stabilized, FCC, FG
[EINECS(EC#)]

240-555-8
[Molecular Formula]

C12H22O2
[MDL Number]

MFCD00036582
[MOL File]

16491-54-6.mol
[Molecular Weight]

198.3
Chemical PropertiesBack Directory
[Melting point ]

225-229 °C(lit.)
[density ]

0.87 g/mL at 25 °C(lit.)
[FEMA ]

3612 | 1-OCTEN-3-YL BUTYRATE
[refractive index ]

n20/D 1.4295(lit.)
[Fp ]

210 °F
[Odor]

at 10.00 % in dipropylene glycol. fruity floral orchid waxy green privet watery metallic mushroom buttery
[biological source]

synthetic
[Odor Type]

mushroom
[JECFA Number]

1837
[Boiling point ]

225-229°C(lit.)
[Major Application]

flavors and fragrances
[InChI]

1S/C12H22O2/c1-4-7-8-10-11(6-3)14-12(13)9-5-2/h6,11H,3-5,7-10H2,1-2H3
[InChIKey]

LZWFXVJBIZIHCH-UHFFFAOYSA-N
[SMILES]

CCCCCC(OC(=O)CCC)C=C
[LogP]

4.53
[EPA Substance Registry System]

1-Vinylhexyl butyrate (16491-54-6)
Safety DataBack Directory
[WGK Germany ]

2
[RTECS ]

ET7030000
[TSCA ]

TSCA listed
[Storage Class]

10 - Combustible liquids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Allyl alcohol-->Butyric Acid-->olefine ketone-->Bromopentane
Hazard InformationBack Directory
[Description]

l-Octen-3-yl butyrate has a fruity, buttery, strawberry, mushroom odor.
[Chemical Properties]

1-Octen-3-yl butyrate has a fruity, buttery, strawberry, mushroom odor.
[Occurrence]

Reported found in passion fruit, lemon peel oil and lavender oil.
[Uses]

GB 2760-1996 specifies 1-OCTEN-3-YL BUTYRATE as a permitted edible flavoring. It is mainly used in the formulation of mushroom-type flavorings.
[Definition]

ChEBI: 1-Ethenylhexyl butanoate is a fatty acid ester.
[Aroma threshold values]

Detection: 22 ppb. Aroma characteristics at 1.0%: musty, earthy, mushroom and waxy.
[Taste threshold values]

Taste characteristics at 5 ppm: tuna fish-like, amine and mushroom-like.
[General Description]

Natural occurrence: Passion fruit.
[Biochem/physiol Actions]

Odor at 1.0%
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