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General Material Information

Preferred name para-tert-butyl quinoline
Trivial Name (1,1-Dimethylethyl)quinoline
Short Description quinoline, (1,1-dimethylethyl)-
Formula C13 H15 N
CAS Number 61702-91-8
ECHA Number 262-927-9
FDA UNII Search
Nikkaji Number J561.524K
xLogP3-AA 3.90 (est)
NMR Predictor External link
Synonyms
  • 4-tert- butyl quinoline
  • p-tert- butyl quinoline
  • (tert- butyl) quinoline
  • (tert- butyl)quinoline
  • 4-tert- butylquinoline
  • 5-tert- butylquinoline
  • p-tert- butylquinoline
  • p-tertiary- butylquinoline
  • quinoline, (1,1-dimethylethyl)-
  • 5-tert-butylquinoline
  • (1,1-Dimethylethyl)quinoline

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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:2933.40.7050
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 185.26954650879
Boiling Point 286 to 287°C @ 760 mm Hg
Vapor Pressure 0.005 mmHg @ 25 °C
Flash Point TCC Value 100 °C TCC
logP (o/w) 3.741 est
Solubility
alcohol Yes
water, 17.97 mg/L @ 25 °C (est) Yes

Organoleptic Properties

Odor Type: Animal
castoreum, leathery, earthy, oakmoss, vetiver
General comment At 100.00 %. castoreum leather earthy oakmoss vetiver

Potential Uses

Applications
Odor purposes Castoreum, Moss
Cosmetic purposes Perfuming agents

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:
fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for para-tert-butyl quinoline usage levels up to:
1.0000 % in the fragrance concentrate.
Recommendation for para-tert-butyl quinoline 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):61702-91-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :109127
National Institute of Allergy and Infectious Diseases:Data
5-tert-butylquinoline
Chemidplus:0061702918