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General Material Information

Preferred name rhubarb oxirane
Trivial Name 3,4,4a,5,8,8a-Hexahydro-3′,7-dimethylspiro[1,4-methanonaphthalene-2(1H),2′-oxirane]
Short Description rhubofix (Firmenich)
Formula C14 H20 O
CAS Number 41816-03-9
Deleted CAS Number 177771-99-2
ECHA Number 255-560-0
FDA UNII Search
Nikkaji Number J248.398J
xLogP3-AA 2.50 (est)
NMR Predictor External link
Synonyms
  • 3,4,4a,5,8,8a- hexahydro-3',7 (or 6)-dimethylspiro(1,4-methanonaphthalene-2(1H),2'-oxirane)
  • 3,4,4a,5,8,8a- hexahydro-3',7'-dimethyl spiro(1,4-methanonaphthalene-2(1H),2'-oxirane)
  • 3,4,4a,5,8,8a- hexahydro-3',7'-dimethylspiro(1,4-methanonaphthalene-2(1H),2'-oxirane)
  • 3,4,4a,5,8,8a- hexahydro-3',7'-dimethylspiro[1,4-methanonaphthalene-2(1H),2'-oxirane]
  • 3',7'- hexahydrodimethyl spiromethanonaphthalene oxirane
  • rhubofix (Firmenich)
  • rubofin
  • spiro(1,4-methanonaphthalene-2(1H),2'-oxirane), 3,4,4a,5,8,8a-hexahydro-3',7-dimethyl-
  • Spiro[1,4-methanonaphthalene-2(1H),2′-oxirane], 3,4,4a,5,8,8a-hexahydro-3′,7-dimethyl-
  • 3,4,4a,5,8,8a-Hexahydro-3′,7-dimethylspiro[1,4-methanonaphthalene-2(1H),2′-oxirane]
  • Rhubofix

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Literature & References

NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:41816-03-9
Pubchem (cid):94522
Pubchem (sid):135049897
Publications by Info
Rhubofix

Other Information

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 204.31260681152
Specific gravity @ 20 °C
Pounds per Gallon 8.522 to 8.606
Refractive Index 1.502 to 1.508 @ 20 °C
Acid Value 1 max KOH/g
Vapor Pressure 0.003 mmHg @ 25 °C
Flash Point TCC Value 100 °C TCC
logP (o/w) 3.79 est
Solubility
alcohol Yes
water, 21.56 mg/L @ 25 °C (est) Yes
Stability
APC: traces - 0.2% Unspecified
candle: traces - 0.5% Unspecified
detergent: traces - 0.2% Unspecified
fine fragrances: traces - 0.5% Unspecified
shampoo: traces - 0.2% Unspecified
shower gel: traces - 0.2% Unspecified
soap: traces - 0.2% Unspecified
softener: traces - 0.2% Unspecified

Organoleptic Properties

Odor Type: Woody
fresh, woody, spicy, floral, fruity, rhubarb, zesty
Odor strength medium , recommend smelling in a 10.00 % solution or less
Substantivity 96 hour(s) at 100.00 %
Luebke, William tgsc, (1987) At 10.00 % in dipropylene glycol. fresh woody spicy floral fruity rhubarb zesty
RHUBOFIX ® has the ability to fill out a fragrance. It blends very well with woody, spicy, rose, bergamot and lavender notes. With salicylates, interesting spicy effects can be obtained particularly if sweetened by heliotropin or similar materials. Its delicate green-woody nuance also harmonizes effectively with citrus notes, in particular lemon and grapefruit. Complex woody, spicy, floral and fruity note. It has a zesty freshness and unique green rhubarb effect
General comment Complex woody, spicy, floral and fruity note. It has a zesty freshness and unique green rhubarb effect

Potential Uses

Applications
Odor purposes Bergamot, Grapefruit, Jasmin, Lavender, Rose, Spice, Vetiver, Woody
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 rhubarb oxirane usage levels up to:
0.5000 % in the fragrance concentrate.
Recommendation for rhubarb oxirane 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):41816-03-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :94522
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
Chemidplus:0041816039