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Substance Name: 2-Methyl-3-furanthiol
RN: 28588-74-1
UNII: N21RW1N179
InChIKey: RUYNUXHHUVUINQ-UHFFFAOYSA-N

Note

  • Possible off-flavor in stored orange juice.

Molecular Formula

  • C5-H6-O-S

Molecular Weight

  • 114.167
 
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Names and Synonyms

Name of Substance

  • 2-Methyl-3-furanthiol

Synonyms

  • 2-Methyl-3-furanthiol
  • 2-Methyl-3-furylmercaptan
  • 2-Methyl-3-furylthiol
  • 2-Methyl-3-mercaptofuran
  • 3-Furanthiol, 2-methyl-
  • EINECS 249-094-7
  • FEMA No. 3188
  • UNII-N21RW1N179

Systematic Names

  • 2-Methylfuran-3-thiol
  • 3-Furanthiol, 2-methyl-

Superlist Name

  • 2-Methyl-3-furanthiol

Registry Numbers

CAS Registry Number

  • 28588-74-1

FDA UNII

  • N21RW1N179

System Generated Number

  • 0028588741

Structure Descriptors

InChI

1S/C5H6OS/c1-4-5(7)2-3-6-4/h2-3,7H,1H3

InChIKey

RUYNUXHHUVUINQ-UHFFFAOYSA-N

Smiles

c1(c(occ1)C)S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 100mg/kg (100mg/kg)   Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980.