EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

trimethyl-3-cyclopentenyl acetonitrile
cantryl (Symrise)

Supplier Sponsors

Name:2-(2,2,3-trimethyl-1-cyclopent-3-enyl)acetonitrile
CAS Number: 15373-31-6Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:239-405-4
Nikkaji Web:J218.411G
XlogP3-AA:2.10 (est)
Molecular Weight:149.23655000
Formula:C10 H15 N
NMR Predictor:Predict (works with chrome or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.90700 to 0.91300 @ 25.00 °C.
Pounds per Gallon - (est).: 7.547 to 7.597
Refractive Index:1.46400 to 1.46900 @ 20.00 °C.
Boiling Point: 230.00 to 231.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.067000 mmHg @ 25.00 °C. (est)
Vapor Density:5.2 ( Air = 1 )
Flash Point: 210.00 °F. TCC ( 98.89 °C. )
logP (o/w): 2.837 (est)
Soluble in:
 alcohol
 water, 59.81 mg/L @ 25 °C (est)
Stability:
 AP roll-on 15% (very good)
 bleach (poor)
 body lotion (good)
 cleaner APC liquid (very good)
 cleaner liquid citric acid (excellent)
 detergent powder conc. (very good)
 shampoo/shower gel (excellent)
 soap (very good)
 
Organoleptic Properties:
Odor Type: pine
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
Substantivity:44 hour(s) at 100.00 %
pine rosemary hay
Odor Description:at 10.00 % in dipropylene glycol. pine rosemary hay
Odor and/or flavor descriptions from others (if found).
Symrise
Cantryl®
Odor Description:powerful odor with pine, rosemary and hay-like tonalities
Stable in: body lotion (good), shampoo (excellent), soap (very good), ap roll-on (very good), powder (very good), cleaner citric (excellent), cleaner apc (very good), bleach (poor).
Tadimety Aromatics
Antryl
Odor Description:Powerful Odor with Pine, rosemary and hay like tonalities
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Associate Allied Chemicals
Cantryl
About
Moellhausen
15373-31-6
Penta International
2,2,3-TRIMETHYLCYCLOPENT-3-ENYL ACETONITRILE
Symrise
Cantryl®
Odor: powerful odor with pine, rosemary and hay-like tonalities
Use: Stable in: body lotion (good), shampoo (excellent), soap (very good), ap roll-on (very good), powder (very good), cleaner citric (excellent), cleaner apc (very good), bleach (poor).
Tadimety Aromatics
Antryl
Odor: Powerful Odor with Pine, rosemary and hay like tonalities
Vigon International
Cantryl
 
Safety Information:
European information :
Most important hazard(s):
Xi - Irritant
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
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 > 2000 mg/kg

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
 
Recommendation for trimethyl-3-cyclopentenyl acetonitrile flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):15373-31-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :85833
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2-(2,2,3-trimethyl-1-cyclopent-3-enyl)acetonitrile
Chemidplus:0015373316
 
References:
 2-(2,2,3-trimethyl-1-cyclopent-3-enyl)acetonitrile
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:15373-31-6
Pubchem (cid):85833
Pubchem (sid):135043247
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (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
 
Potential Blenders and core components note
For Odor
floral
genet concrete
FR
For Flavor
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 antryl (Tadimety)
 cantryl (Symrise)
3-cyclopentene-1-acetonitrile, 2,2,3-trimethyl-
2,2,3-trimethyl cyclopent-3-enyl acetonitrile
2-(2,2,3-trimethyl-1-cyclopent-3-enyl)acetonitrile
2,2,3-trimethyl-3-cyclopentene-1-acetonitrile
(2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile
2,2,3-trimethylcyclopent-3-enylacetonitrile
 

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Notes:
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