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Safety Information

W361208

Sigma-Aldrich

1-Octen-3-yl butyrate

≥97%, stabilized, FCC, FG

Synonym(s):

Butanoic acid 1-octen-3-yl ester

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About This Item

Empirical Formula (Hill Notation):
C12H22O2
CAS Number:
16491-54-6
Molecular Weight:
198.30
FEMA Number:
3612
EC Number:
240-555-8
MDL number:
MFCD00036582
UNSPSC Code:
12164502
PubChem Substance ID:
24901808
Flavis number:
9.282

biological source

synthetic

Quality Level

300

grade

FG
Halal
Kosher

reg. compliance

EU Regulation 1334/2008 & 872/2012
FCC

Assay

≥97%

contains

α-tocopherol, synthetic as stabilizer

refractive index

n20/D 1.4295 (lit.)

bp

225-229 °C (lit.)

density

0.87 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

mushroom; fruity; buttery

SMILES string

CCCCCC(OC(=O)CCC)C=C

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

InChI key

LZWFXVJBIZIHCH-UHFFFAOYSA-N

General description

Natural occurrence: Passion fruit.

Biochem/physiol Actions

Odor at 1.0%
Taste at 5 ppm

Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

209.8 °F - closed cup

Flash Point(C)

98.8 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

JAN Code

W361208-4KG:
W361208-100G-K:4548173319438
W361208-SAMPLE-K:
W361208-1KG-K:4548173319445
W361208-100G:
W361208-SAMPLE:
W361208-BULK-K:
W361208-1KG:
W361208-VAR-K:
W361208-4KG-K:4548173319452

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Certificates of Analysis (COA)

Lot/Batch Number
MKCD4856
STBF0308V
MKBK9717V
08406JU
01226JU

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Organoleptic Characteristics of Flavor Materials
Mosciano, G.
Perfumer & Flavorist, 30, 58-58 (2005)

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