(S)-1-methoxy-3-heptane thiol

Full Material List
(3S)-1-methoxyheptane-3-thiol

Identifiers

FEMA 4162
CAS 400052-49-5
EINECS N/A
Synonyms
  • aruscol (Firmenich)
  • 3- heptanethiol, 1-methoxy-, (3S)-
  • (S1)- methoxy-3-heptane thiol
  • (S)-1- methoxy-3-heptanethiol
  • (S1)- methoxy-3-heptanethiol
  • (3S)-1- methoxyheptane-3-thiol
JECFA Food Flavoring 1671
JECFA Food Additive N/A
DG SANTE Food Flavourings 12.276 (S)-1-methoxy-3-heptanethiol
DG SANTE Food Contact Materials N/A
FDA UNII 7QSJ4T5U48
CoE Number N/A
XlogP3-AA N/A
Molecular Weight 162.29566
Molecular Formula C8 H18 O S

Organoleptic

Organoleptic Notes
  • 1. Odor Type: sulfurous Odor Strength:high ,recommend smelling in a 1.00 % solution or less
  • Substantivity:23 hour(s) at 100.00 %
  • sulfurous green fruit tropical fruit currant bud black currant bud passion fruit tropical fatty herbal
  • Odor Description:at 1.00 % in dipropylene glycol. sulfurous green tropical fruit black currant bud passion fruit tropical fatty herbalLuebke, William tgsc, (2021)
  • Odor sample from: Firmenich Inc.
Odor sulfurous
sulfurous, green, fruit, tropical, currant, bud, black, passion, fatty, herbal,
Flavor fruity
fruity, berry, sulfurous, rhubarb, passion, fruit, tropical, herbal,

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Properties

Food Chemicals Codex Listed No
Appearance colorless clear liquid (est)
Assay 99.00 to 100.00
Specific Gravity 1.15400 to 1.15800 @ 25.00 °C.
Lbs/Gal (est) 9.602 to 9.636
Refractive Index 1.43100 to 1.43300 @ 20.00 °C.
Melting Point N/A
Boiling Point 203.00 to 204.00 °C. @ 760.00 mm Hg
Flash Point 212.00 °F. TCC ( 78.20 °C. ) (est)
Acid Value N/A
Vapor Pressure 0.400000 mmHg @ 25.00 °C. (est)
Vapor Density N/A
logP (o/w) 2.810 (est)
Soluble In
  • alcohol
  • water, very slightly
  • water, 230.2 mg/L @ 25 °C (est)
  • water
Occurrence
  • ruta chalepensis
  • sage clary sage