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General Material Information

Preferred name dodecane nitrile
Trivial Name Dodecanenitrile
Short Description clonal (IFF)
Formula C12 H23 N
CAS Number 2437-25-4
ECHA Number 219-440-1
FDA UNII TL45I6761P
Nikkaji Number J42.966J
Beilstein Number 0970348
MDL MFCD00001946
Bio Activity Summary External link
NMR Predictor External link
Synonyms
  • aldinyle 3881 (Synarome)
  • clonal (IFF)
  • 1-cyanoundecane
  • decyl acetonitrile
  • decylacetonitrile
  • dodecanenitrile
  • dodecanonitrile
  • dodecyl nitrile
  • dodecylnitrile
  • lauric acid nitrile
  • lauric nitrile
  • lauronitrile
  • lauryl nitrile
  • mandaryl
  • undecyl cyanide
  • N- undecyl cyanide
  • n-Dodecanonitrile
  • 1-Cyanoundecane
  • NSC 1804
  • Arneel 12

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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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2926.90.5050
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 181.32231140137
Specific gravity @ 25 °C
Pounds per Gallon 6.815 to 6.881
Specific gravity @ 20 °C
Pounds per Gallon 6.831 to 6.898
Refractive Index 1.433 to 1.438 @ 20 °C
Melting Point 3 to 4°C @ 760 mm Hg
Acid Value 2 max KOH/g
Vapor Pressure 0.005 mmHg @ 25 °C
Flash Point TCC Value 93.89 °C TCC
logP (o/w) 5.02
Shelf life 36 months (or longer if stored properly.)
Storage notes Store in cool, dry place in tightly sealed containers, protected from heat and light.
Solubility
alcohol Yes
water, 2.51 mg/L @ 25 °C (est) Yes
Stability
alcoholic lotion Unspecified
antiperspirant Unspecified
bleach Unspecified
deo stick Unspecified
detergent Unspecified
fabric softener Unspecified
hard surface cleaner Unspecified
shampoo Unspecified
soap Unspecified

Organoleptic Properties

Odor Type: Citrus
dry, citrus, orange peel, metallic, spicy
Odor strength medium , recommend smelling in a 10.00 % solution or less
Substantivity 240 hour(s) at 100.00 %
Luebke, William tgsc, (1995) At 10.00 % in dipropylene glycol. dry citrus orange peel metallic spicy
General comment Dry orange peel note for citrus, bergamot cologne types. Excellent stability. Ozonic, mettalic, aldehydic, zesty, grapefruit

Occurrences

Safety Information

Safety information

Preferred SDS: View
European information :
Most important hazard(s):
Xn - Harmful.
R 22 - Harmful if swallowed.
S 02 - Keep out of the reach of children.
S 20/21 - When using do not eat, drink or smoke.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
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:
oral-rat LD50 500 mg/kg
Journal of Pharmacology and Experimental Therapeutics. Vol. 90, Pg. 260, 1947.

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 dodecane nitrile usage levels up to:
5.0000 % in the fragrance concentrate.
Recommendation for dodecane 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 Substance Registry Services (TSCA):2437-25-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :17092
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 3276
WGK Germany:2
dodecanenitrile
Chemidplus:0002437254
RTECS:JR2600000 for cas# 2437-25-4