| Identification | More | [Name]
Furfuryl thioacetate | [CAS]
13678-68-7 | [Synonyms]
Ethanethioic acid S-(2-furanylmethyl) ester
FEMA 3162
FURFURYL THIOACETATE
S-FURFURYL ACETOTHIOATE
S-FURFURYL THIOACETATE
THIOACETIC ACID S-FURFURYL ESTER
Acetic acid, thio-, S-furfuryl ester
Ethanethioicacid,S-(2-furanylmethyl)ester(9CI)
Furfurylthiol acetate
S-(2-Furylmethyl) ethanethioate
S-furfuryl ethanethioate
FURFURYL THIOACETATE 98+%
FURFURYL THIOACETATE FEMA NO.3162
S-(2-furfuryl)-ethanethioate,S-(2-furfuryl)-ethanethioate,S-(2-furanylmethyl)esterethanethioicacid
Furfuryl tioacetate
(Furan-2-yl)methanethiol acetate
Thioacetic acid S-(2-furanylmethyl) ester
Thioacetic acid S-(2-furylmethyl) ester | [EINECS(EC#)]
237-173-9 | [Molecular Formula]
C7H8O2S | [MDL Number]
MFCD00010083 | [Molecular Weight]
156.2 | [MOL File]
13678-68-7.mol |
| Chemical Properties | Back Directory | [Appearance]
dark brown liquid | [Boiling point ]
90-92 °C/12 mmHg (lit.) | [density ]
1.171 g/mL at 25 °C(lit.)
| [FEMA ]
3162 | [refractive index ]
n20/D 1.526(lit.)
| [Fp ]
199 °F
| [storage temp. ]
2-8°C | [form ]
Liquid | [color ]
Dark brown | [Specific Gravity]
1.171 | [Odor]
at 0.10 % in propylene glycol. sulfury burnt roasted nutty coffee | [biological source]
synthetic | [Odor Type]
sulfurous | [JECFA Number]
1074 | [Major Application]
flavors and fragrances | [InChI]
1S/C7H8O2S/c1-6(8)10-5-7-3-2-4-9-7/h2-4H,5H2,1H3 | [InChIKey]
LQOUTUIIYXYBQW-UHFFFAOYSA-N | [SMILES]
CC(SCC1=CC=CO1)=O | [LogP]
1.66 | [CAS DataBase Reference]
13678-68-7(CAS DataBase Reference) | [NIST Chemistry Reference]
Ethanethioic acid, S-(2-furanylmethyl) ester(13678-68-7) | [EPA Substance Registry System]
13678-68-7(EPA Substance) |
| Safety Data | Back Directory | [Symbol(GHS) ]
GHS07 | [Signal word ]
Warning | [Hazard statements ]
H315-H319-H335 | [Precautionary statements ]
P261-P264-P280-P304+P340+P312-P337+P313-P403+P233 | [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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S24/25:Avoid contact with skin and eyes . | [RIDADR ]
UN 3334 | [WGK Germany ]
3
| [TSCA ]
Yes | [HazardClass ]
9 | [HS Code ]
29321900 | [Storage Class]
10 - Combustible liquids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Chemical Properties]
dark brown liquid | [Chemical Properties]
Furfuryl thioacetate has a burnt, roasted odor. | [Occurrence]
Reported found as a constituent in coffee | [Uses]
S-Furfuryl thioacetate (S-2-furfuryl thioacetate) has been used in lipase (from Candida rugosa) mediated synthesis of 2-furfurylthiol. | [Uses]
2-Furfurylthiol Acetate is a sulfur-substituted furan derivative used as flavouring agent. 2-Furfurylthiol Acetate is a precursor to furfurylmercaptan which is very prone to oxidation to the disulfide. We will provide a detailed procedure for the preparation of the thiol from the thioacetate with spectral data upon request. | [Uses]
Furfuryl thioacetate is a sulfur-substituted furan derivative used as flavouring agent. e. We will provide a detailed procedure for the preparation of the thiol from the thioacetate with spectral data upon request.
| [Definition]
ChEBI: Furfuryl thioacetate is a heteroarene. | [Taste threshold values]
Taste characteristics at 1 ppm: roasted, alliaceous, garlic, coffee, meaty, savory and sulfureous. | [General Description]
Furfuryl thioacetate is a sulfur-containing flavor compound mainly found in coffee. |
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