50746-10-6

Name 3-MERCAPTO-3-METHYL-1-BUTYL-1-FORMATE
CAS 50746-10-6
Molecular Formula C6H12O2S
MDL Number MFCD08457872
Molecular Weight 148.22
MOL File 50746-10-6.mol
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Chemical Properties

Boiling point  196℃
density  1.019
FEMA  3855 | 3-MERCAPTO-3-METHYLBUTYL FORMATE
refractive index  n20/D1.460-1.462
Fp  76℃
storage temp.  2-8°C
solubility  Chloroform (Sparingly), Methanol (Slightly)
form  neat
pka 10.88±0.10(Predicted)
color  Colourless
Odor at 0.10 % in dipropylene glycol. sulfurous catty caramelised onion; roast coffee, roast meat, with a tropical nuance on dilution
Odor Type sulfurous
JECFA Number 549
InChI InChI=1S/C6H12O2S/c1-6(2,9)3-4-8-5-7/h5,9H,3-4H2,1-2H3
InChIKey VTAPYUYITKYXJB-UHFFFAOYSA-N
SMILES C(OC=O)CC(S)(C)C
LogP 1.42

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

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