51755-85-2

Name 3-(Methylthio)hexyl acetate
CAS 51755-85-2
Molecular Formula C9H18O2S
MDL Number MFCD00236623
Molecular Weight 190.3
MOL File 51755-85-2.mol
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Chemical Properties

Boiling point  216 °C
density  0.982
FEMA  3789 | 3-(METHYLTHIO)HEXYL ACETATE
refractive index  1.4640
Fp  76 °C
Odor at 0.10 % in dipropylene glycol. sulfury green spicy vegetable tropical
biological source synthetic
Odor Type sulfurous
JECFA Number 481
Major Application flavors and fragrances
InChI InChI=1S/C9H18O2S/c1-4-5-9(12-3)6-7-11-8(2)10/h9H,4-7H2,1-3H3
InChIKey VIQXICKUKPVFRK-UHFFFAOYSA-N
SMILES C(OC(=O)C)CC(SC)CCC
LogP 2.71
NIST Chemistry Reference 3-(Methylthio)hexyl acetate(51755-85-2)

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
RIDADR  UN 3334
WGK Germany  3
Storage Class 10 - Combustible liquids
Hazard Classifications Skin Irrit. 2

Hazard Information

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