para-anisyl nitrile
tonkanyle
 
Notes:
None found
Synonyms   Articles   Notes   Search
4-methoxybenzonitrile (Click)
CAS Number: 874-90-8Picture of molecule
Other: 721942-48-9
ECHA EINECS - REACH Pre-Reg: 212-871-6
Nikkaji Web: J195.161K
MDL: MFCD00001818
XlogP3: 1.90 (est)
Molecular Weight: 133.14999000
Formula: C8 H7 N O
BioActivity Summary: listing
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
PubMed: Search
NCBI: Search
Synonyms   Articles   Notes   Search   Top
Physical Properties:
Appearance: white crystalline powder (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Melting Point: 61.00 to  62.00 °C. @ 760.00 mm Hg
Boiling Point: 256.00 to  257.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.014999 mm/Hg @ 25.00 °C.
Flash Point: 135.00 °F. TCC ( 57.22 °C. )
logP (o/w): 1.700
Soluble in:
 alcohol
 water, 1715 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 alkalis
Synonyms   Articles   Notes   Search   Top
Organoleptic Properties:
Odor Type: floral
Odor Strength: medium ,
recommend smelling in a 10.00 % solution or less
 sweet  floral  hawthorn  hay  coumarinic  
Odor Description:
at 10.00 % in dipropylene glycol. 
sweet floral hawthorn hay coumarin
Luebke, William tgsc, (1984)
Substantivity: 400 Hour(s)
  
Synonyms   Articles   Notes   Search   Top
Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
Synonyms   Articles   Notes   Search   Top
Suppliers:
Carbosynth
For experimental / research use only.
4-Methoxybenzonitrile
EMD Millipore
For experimental / research use only.
4-Methoxybenzonitrile
Ernesto Ventós
TONKANYLE II SYNAROME
Odor: TONKA, BALSAMIC, POWDERY
PCAS
4-Methoxy Benzonitrile
Penta International
ANISONITRILE
Santa Cruz Biotechnology
For experimental / research use only.
4-Methoxybenzonitrile
Sigma-Aldrich: Aldrich
For experimental / research use only.
4-Methoxybenzonitrile 99%
TCI AMERICA
For experimental / research use only.
Anisonitrile >98.0%(GC)
Synonyms   Articles   Notes   Search   Top
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xn - Harmful.
R 20/21/22 - Harmful by inhalation, in contact with skin and if swallowed.
S 02 - Keep out of the reach of children.
S 22 - Do not breath dust.
S 24/25 - Avoid contact with skin and eyes.
S 37/39 - Wear suitable gloves and eye/face protection.
S 45 - In case of accident or if you feel unwell seek medical advice immediately.
 
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
Synonyms   Articles   Notes   Search   Top
Safety in Use Information:
Category: fragrance agents
Recommendation for para-anisyl nitrile usage levels up to:
  0.6000 % in the fragrance concentrate.
 
Recommendation for para-anisyl nitrile flavor usage levels up to:
 not for flavor use.
Synonyms   Articles   Notes   Search   Top
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA): 874-90-8
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 70129
National Institute of Allergy and Infectious Diseases: Data
WISER: UN 2811
WGK Germany: 3
 4-methoxybenzonitrile
Chemidplus: 0000874908
Synonyms   Articles   Notes   Search   Top
References:
 4-methoxybenzonitrile
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 874-90-8
Pubchem (cid): 70129
Pubchem (sid): 135026754
Synonyms   Articles   Notes   Search   Top
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
CHEMBL: View
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2926.90.4800
ChemSpider: View
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
animal
 costus valerolactoneFR
anisic
para-acetanisoleFL/FR
balsamic
isoamyl benzoateFL/FR
 amyris wood oilFL/FR
siam benzoin resinoidFL/FR
 benzyl cinnamateFL/FR
isobornyl acetateFL/FR
 cinnamyl alcoholFL/FR
 ethyl cinnamateFL/FR
 fir balsam absoluteFR
3-phenyl propyl alcoholFL/FR
 styrax resinoid (liquidambar styraciflua)FL/FR
buttery
 acetoinFL/FR
caramellic
 ethyl maltolFL/FR
chocolate
isoamyl phenyl acetateFL/FR
citrus
sweet orange peel oil c.p. brazilFL/FR
coumarinic
 tonka furanoneFL/FR
floral
 acetophenoneFL/FR
alpha-amyl cinnamaldehydeFL/FR
isoamyl salicylateFL/FR
para-anisaldehyde dimethyl acetalFR
 citronellolFL/FR
 dihydrojasmoneFL/FR
 dimethyl anthranilateFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 ethyl phenyl acetateFL/FR
 floral pyranolFR
 geraniolFL/FR
 heliotropinFL/FR
 heliotropyl acetoneFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hydroxycitronellalFL/FR
 lilyallFR
ortho-methyl acetophenoneFL/FR
 neroli oil bigardeFL/FR
 nerolidolFL/FR
 nonanolFL/FR
 ocean propanalFL/FR
 petitgrain oil paraguayFL/FR
 phenethyl alcoholFL/FR
 phenethyl phenyl acetateFL/FR
 rose butanoateFL/FR
 ylang ylang flower oilFL/FR
fruity
 raspberry ketoneFL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
green
para-dimethyl hydroquinoneFL/FR
 hexyl 2-methyl butyrateFL/FR
hay
 beeswax absoluteFL/FR
herbal
 apium graveolens seed oil indiaFL/FR
licorice
(E)-anetholFL/FR
minty
 ethyl salicylateFL/FR
mossy
 veramoss (IFF)FR
naphthyl
beta-naphthyl ethyl etherFL/FR
beta-naphthyl methyl etherFL/FR
powdery
para-anisyl alcoholFL/FR
spicy
 cassia bark oil chinaFL/FR
 cuminaldehydeFL/FR
isoeugenyl acetateFL/FR
alpha-methyl cinnamaldehydeFL/FR
 methyl isoeugenolFL/FR
sweet
 vanilla bean absolute (vanilla planifolia)FL/FR
terpenic
alpha-terpineolFL/FR
tonka
 coumarinFR
 deertongue oleoresinFR
 flouve absoluteFR
 tonka bean absoluteFR
vanilla
 ethyl vanillinFL/FR
woody
 patchouli ethanoneFR
 santallFR
 woody acetateFR
 
For Flavor
 
No flavor group found for these
ortho-methyl acetophenoneFL/FR
beta-naphthyl methyl etherFL/FR
 tonka furanoneFL/FR
aldehydic
 nonanolFL/FR
anise
(E)-anetholFL/FR
para-dimethyl hydroquinoneFL/FR
anisic
para-acetanisoleFL/FR
balsamic
siam benzoin resinoidFL/FR
 ethyl cinnamateFL/FR
 styrax resinoid (liquidambar styraciflua)FL/FR
berry
 heliotropyl acetoneFL/FR
brown
 beeswax absoluteFL/FR
caramellic
 ethyl maltolFL/FR
cherry
 heliotropinFL/FR
citrus
sweet orange peel oil c.p. brazilFL/FR
 petitgrain oil paraguayFL/FR
alpha-terpineolFL/FR
creamy
 acetoinFL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
floral
isoamyl phenyl acetateFL/FR
 citronellolFL/FR
 dihydrojasmoneFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 geraniolFL/FR
 neroli oil bigardeFL/FR
 ocean propanalFL/FR
 phenethyl alcoholFL/FR
 ylang ylang flower oilFL/FR
fruity
isoamyl benzoateFL/FR
para-anisyl alcoholFL/FR
 dimethyl anthranilateFL/FR
 raspberry ketoneFL/FR
 rose butanoateFL/FR
green
isoamyl salicylateFL/FR
 cinnamyl alcoholFL/FR
 hexyl 2-methyl butyrateFL/FR
 nerolidolFL/FR
herbal
 apium graveolens seed oil indiaFL/FR
honey
 ethyl phenyl acetateFL/FR
 phenethyl phenyl acetateFL/FR
minty
 ethyl salicylateFL/FR
powdery
 acetophenoneFL/FR
beta-naphthyl ethyl etherFL/FR
spicy
 benzyl cinnamateFL/FR
 cassia bark oil chinaFL/FR
 cuminaldehydeFL/FR
isoeugenyl acetateFL/FR
alpha-methyl cinnamaldehydeFL/FR
 methyl isoeugenolFL/FR
3-phenyl propyl alcoholFL/FR
sweet
 vanilla bean absolute (vanilla planifolia)FL/FR
tropical
alpha-amyl cinnamaldehydeFL/FR
vanilla
 ethyl vanillinFL/FR
waxy
alpha-hexyl cinnamaldehydeFL/FR
 hydroxycitronellalFL/FR
woody
 amyris wood oilFL/FR
isobornyl acetateFL/FR
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 acacia cassie farnesianaFR
 almondFR
 amberFR
 ambrene 
 angel 
 aniseFR
 appleFR
 apres l'ondee 
 apricotFR
 balsamFR
 bananaFR
 bluebell 
 bouquetFR
 buchuFL/FR
 cherryFR
 cherry blossomFR
 christmas blendsFR
 chypreFR
 clover trefle le'trefle incarnatFR
 coconut tropicalFR
 cologneFR
 crabapple blossomFR
 decumaria 
 elder flowerFR
 fennelFL/FR
 fern fougereFR
 floralFR
 gardeniaFR
 genet genista broomFR
 ginger whiteFR
 gooseberryFR
 grapeFR
 grass sweetFR
 hawthornFR
 hay new mown hay foin coupeFR
 heliotropeFR
 herbalFR
 hibiscusFR
 honey mielFR
 honeysuckle chevrefeuilleFR
 jasminFR
 jonquil narcissus jonquillaFR
 lemonFR
 lilac lilas syringaFR
 limeFR
 linden blossom limeflower tilleulFR
 magnoliaFR
 melon watermelon muskmelon cantaloupe 
 mimosaFR
 nut walnut 
 orangeFR
 orchidFR
 orientalFR
 pearFR
 peppermintFR
 pineappleFR
 powderFR
 raspberryFR
 sassafrasFR
 spearmintFR
 strawberryFR
 sweet peaFR
 tuberoseFR
 valerianFL/FR
 vanillaFR
 violetFR
 wallflowerFR
 wisteria wistaria glycineFR
 ylang ylangFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
 anisonitrile
p-anisonitrile
para-anisonitrile
p-anisyl nitrile
 aubepine nitrile
4-cyanoanisole
p-cyanoanisole
para-cyanoanisole
4-methoxy-benzonitrile
4-methoxybenzenecarbonitrile
4-methoxybenzonitril
4-methoxybenzonitrile
p-methoxybenzonitrile
para-methoxybenzonitrile
p-methoxyphenyl cyanide
para-methoxyphenyl cyanide
 tonkanyle
Synonyms   Articles   Notes   Search   Top
Articles:
PubMed: Autodisplay of nitrilase from Klebsiella pneumoniae and whole-cell degradation of oxynil herbicides and related compounds.
PubMed: Reductions of aliphatic and aromatic nitriles to primary amines with diisopropylaminoborane.
PubMed: Theoretical surface-enhanced Raman spectra study of substituted benzenes II. Density functional theoretical SERS modelling of o-, m-, and p-methoxybenzonitrile.
PubMed: Synthesis and structure-activity relationships of the first ferrocenyl-aryl-hydantoin derivatives of the nonsteroidal antiandrogen nilutamide.
PubMed: Anomalous reactivity of radical cations produced by photosensitized oxidation of 4-methoxybenzyl alcohol derivatives: role of the sensitizer.
PubMed: Beta-aryl eliminations from Rh(I) iminyl complexes.
PubMed: A mechanistic investigation of the carbon-carbon bond cleavage of aryl and alkyl cyanides using a cationic RhIII silyl complex.
PubMed: Vibrational analysis of substituted benzonitriles. III. Transferability of force constants--the case of some halogeno-, methoxy- and nitro-benzonitriles.
PubMed: [Catalysts for demethylation of methoxybenzonitrile in liquid-phase (author's transl)].
PubMed: Aminonitriles and aminothioamides related to natural amino acids.
Synonyms   Articles   Notes   Search   Top
Please share your Comments.
Email Address:
 
 
 
 
Top of Page Home
Copyright © 1980-2017 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy