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meta-thiocresol

Chemical Structure

General Material Information

Preferred name meta-thiocresol
Trivial Name 3-Methylbenzenethiol
Short Description 3-toluenethiol
Formula C7 H8 S
CAS Number 108-40-7
ECHA Number 203-578-4
FDA UNII 0TK859NX9S
Nikkaji Number J5.076H
Beilstein Number 1851959
MDL MFCD00004843
NMR Predictor External link
Synonyms
  • benzenethiol, 3-methyl-
  • 3-mercaptotoluene
  • 3-methyl benzene thiol
  • 3-methyl thiophenol
  • 3-methylbenzene-1-thiol
  • 3-methylbenzenethiol
  • 3-methylthiophenol
  • 3-thiocresol
  • m- thiocresol
  • 3-toluene thiol
  • meta- toluene thiol
  • toluene-3-thiol
  • 3-toluenethiol
  • m- toluenethiol
  • m-Toluenethiol
  • 3-Methylbenzenethiol
  • m-Thiocresol
  • m-Tolyl mercaptan
  • m-Methylbenzenethiol
  • m-Methylthiophenol
  • 3-Methylthiophenol
  • m-Mercaptotoluene
  • (3-Methylphenyl)thiol
  • 3-Methylphenyl mercaptan
  • m-Tolylthiol
  • 3-Mercaptotoluene
  • NSC 81219
  • 3-Methylbenzene-1-thiol

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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Literature & References

3-methylbenzenethiol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:108-40-7
Pubchem (cid):7930
Pubchem (sid):134970513
Publications by US Patents
3,952,024 - Furfurylthioacetone
Certain 2,5-dimethyl-3-thiopyrazines
Flavoring agent

Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2930.90.2900
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 124.20575714111
Specific gravity @ 20 °C
Pounds per Gallon 8.706 to 8.731
Refractive Index 1.575 to 1.577 @ 20 °C
Boiling Point 194 to 195°C @ 760 mm Hg
Vapor Pressure 0.803 mmHg @ 25 °C
Flash Point TCC Value 72.8 °C TCC
logP (o/w) 2.98 est
Solubility
alcohol Yes
water, 167.9 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Flavor Type: Burnt
burnt
General comment Burnt

Safety Information

Safety information

Preferred SDS: View
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
intraperitoneal-mouse LD50 50 mg/kg
National Technical Information Service. Vol. AD277-689

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in use information

Category:
information only not used for fragrances or flavors
Recommendation for meta-thiocresol usage levels up to:
not for fragrance use.
Recommendation for meta-thiocresol flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):108-40-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :7930
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
3-methylbenzenethiol
Chemidplus:0000108407
RTECS:XT8700000 for cas# 108-40-7