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2,3,6-trimethyl naphthalene

Chemical Structure

General Material Information

Preferred name 2,3,6-trimethyl naphthalene
Trivial Name 2,3,6-Trimethylnaphthalene
Short Description naphthalene, 2,3,6-trimethyl- (8CI)(9CI)
Formula C13 H14
CAS Number 829-26-5
ECHA Number 212-588-8
FDA UNII 0WHV15633Q
Nikkaji Number J102.298I
Bio Activity Summary External link
NMR Predictor External link
Synonyms
  • naphthalene, 2,3,6-trimethyl-
  • naphthalene, 2,3,6-trimethyl- (8CI)(9CI)
  • 2,3,6-trimethylnaphthalene
  • 2,3,6-Trimethylnaphthalene
  • NSC 11848

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

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Literature & References

2,3,6-trimethylnaphthalene
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):13237
Pubchem (sid):134978570
Pherobase:View
Publications by US Patents
3,931,166 - 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
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 170.25457763672
Boiling Point 263 to 264°C @ 760 mm Hg
Vapor Pressure 0.017 mmHg @ 25 °C
Flash Point TCC Value 129.6 °C TCC
logP (o/w) 4.73
Solubility
water, 1.7 mg/L @ 25 °C (exp) Yes

Organoleptic Properties

Flavor Type: Fruity
fruity, dry, fruit dried fruit
General comment Fruity dry

Safety Information

Safety information

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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in use information

Category:
information only not used for fragrances or flavors
Recommendation for 2,3,6-trimethyl naphthalene usage levels up to:
not for fragrance use.
Recommendation for 2,3,6-trimethyl naphthalene flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
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EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :13237
National Institute of Allergy and Infectious Diseases:Data
2,3,6-trimethylnaphthalene
Chemidplus:0000829265