80441-57-2

Name 6-ACETYLTHIOHEXANOIC ACID 97
CAS 80441-57-2
Molecular Formula C8H14O3S
MDL Number MFCD03427073
Molecular Weight 190.26
MOL File 80441-57-2.mol
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Chemical Properties

Boiling point  319.3±25.0 °C(Predicted)
density  1.144 g/mL at 25 °C (lit.)
refractive index  n20/D 1.491(lit.)
Fp  >230 °F
pka 4.73±0.10(Predicted)
InChI 1S/C8H14O3S/c1-7(9)12-6-4-2-3-5-8(10)11/h2-6H2,1H3,(H,10,11)
InChIKey PIFIISOIFYMVLS-UHFFFAOYSA-N
SMILES CC(=O)SCCCCCC(O)=O

Safety Data

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

Hazard Information

Spectrum Detail

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