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General Material Information

Preferred name (E)-3,12-tridecadiene nitrile
Trivial Name (3E)-trideca-3,12-dienenitrile
Short Description trans-3,12-tridecadienenitrile
Formula C13 H21 N
CAS Number 124071-42-7
FDA UNII Search
Nikkaji Number J1.565.153I
xLogP3-AA 4.70 (est)
NMR Predictor External link
Synonyms
  • (3E)- trideca-3,12-dienenitrile
  • (E)-3,12-tridecadienenitrile
  • trans-3,12-tridecadienenitrile

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Other Information

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 191.31736755371
Vapor Pressure 0.002 mmHg @ 25 °C
Flash Point TCC Value 133.4 °C TCC
logP (o/w) 4.673 est
Solubility
alcohol Yes
water, 1.702 mg/L 2 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Mandarin
mandarin
General comment At 1.00 % in dipropylene glycol. mandarin

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 (E)-3,12-tridecadiene nitrile flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :6450538
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
(3E)-trideca-3,12-dienenitrile
Chemidplus:0134769338