nonanal / methyl anthranilate schiff's base
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IUPAC name :methyl 2-(nonylideneamino)benzoate
InChI :InChI=1/C17H25NO2/c1-3-4-5-6-7-8-11-14-18-16-13-10-9-12-15(16)17(19)20-2/h9-10,12-14H,3-8,11H2,1-2H3/b18-14+
InChIKey :KRMRLVKJOSLHQF-NBVRZTHBBK
SMILES :CCCCCCCCC=NC1=CC=CC=C1C(=O)OC
cas number :72894-12-3
(EINECS) number :276-963-8
molar refractivity :83.26 ± 0.5 cm3
parachor :685.4 ± 8.0 cm3
index of refraction :1.497 ± 0.05
surface tension :33.6 ± 7.0 dyne/cm
density :0.96 ± 0.1 g/cm3
polarizability :33.01 ± 0.5 10-24cm3
XlogP : 5.60
molecular weight : 275.3859000 (IUPAC)
formula :C17 H25 N O2
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified
Suppliers :
Vigon :Methyl Anthranilate / Nonanal Schiff Base
organoleptics :
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description:
at 10.00 % in dipropylene glycol.  		sweet floral orangeflower rose aldehydic
Luebke, William tgsc, (1987)
substantivity :400  Hour(s)
properties :
appearence :yellow orange liquid to solid
assay : 96.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.01490 to 1.02370 @ 25.00 °C.
pounds per gallon - calc. : 8.445 to 8.518
refractive index :1.51260 to 1.52210 @ 20.00 °C.
boiling point : 399.00 to 400.00 °C. @ 760.00 mm Hg
flash point :> 200.00  °F.  TCC  ( > 93.33 °C. )
logP (o/w) : 5.60
shelf life : 24.00 month(s) or longer if stored properly.
storage :store in cool, dry place in tightly sealed containers, protected from heat and light.
safety :
most important hazard(s) :Xi - Irritant
  R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
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 37/39 - Wear suitable gloves and eye/face protection.
Oral Toxicity(LD50) : 
  Not determined
Dermal Toxicity(LD50) : 
  Not determined
Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :fragrance agents
 
recommendation for nonanal / methyl anthranilate schiff's base fragrance usage levels up to :
  8.0000 % in the fragrance concentrate.
recommendation for nonanal / methyl anthranilate schiff's base flavor usage levels up to :
 not for flavor use.
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 
methyl 2-(nonylideneamino)benzoate
(EINECS) number :276-963-8
chemidplus :072894123
EPA Substance Registry Services :72894-12-3
references :
 
methyl 2-(nonylideneamino)benzoate
pubchem :743764
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
synonyms :
 aldehyde C-9 / methyl anthranilate schiff's base
 methyl 2-(nonylidene amino) benzoate
 methyl 2-(nonylideneamino)benzoate
 methyl anthranilate / aldehyde C-9 schiff's base
 methyl anthranilate / nonanal schiff's base
 nonimea
soluble in :
 alcohol
insoluble in :
 water
potential blenders :    note
isoamyl undecylenateFL/FR
 benzyl alcoholFL/FR
 butyl benzyl etherFL/FR
 champaca absoluteFR
 citral / methyl anthranilate schiff's baseFR
 citronellalFL/FR
 citronellyl ethoxalateFR
 citronellyl oxyacetaldehydeFL/FR
 citronellyl propionateFL/FR
 clean nitrileFR
 cyclamen aldehyde / methyl anthranilate schiff's baseFR
 cyclohexyl anthranilateFL/FR
(E)-alpha-damasconeFL/FR
(Z)-alpha-damasconeFL/FR
gamma-damasconeFR
isodecanalFL/FR
 decanal / methyl anthranilate schiff's baseFR
(Z)-4-decen-1-alFL/FR
2-decen-1-alFL/FR
(Z)-4-decen-1-yl acetateFL/FR
 decyl formateFR
 dihydrocarvyl acetateFL/FR
 ethyl anthranilateFL/FR
 farnesyl acetateFL/FR
 floral pyranFR
 flower hexeneFR
 geranium rose-scented oil (pelargonium spp.) cubaFR
 geranyl acetateFL/FR
(E)-geranyl linaloolFL/FR
 globulol 
 hawthorn ethanolFR
 honeysuckle absoluteFR
 hydroxycitronellal / methyl anthranilate schiff's baseFR
 labdanum ethanoneFR
 leerall / methyl anthranilate schiff's baseFR
 lilyall / methyl anthranilate schiff's baseFR
 linalyl anthranilateFL/FR
 magnolia decadienalFR
 methyl anthranilateFL/FR
alpha-methyl naphthyl ketoneFL/FR
2-methyl octanalFL/FR
 musk acetateFR
beta-naphthyl ethyl etherFL/FR
beta-naphthyl methyl etherFL/FR
beta-naphthyl methyl ketoneFL/FR
2-naphthyl phenyl ketone 
 nerol oxideFL/FR
 neroli oilFL/FR
 neroli oil CO2 extractFL/FR
 nerolin fragarolFL/FR
 neryl acetateFL/FR
 neryl isovalerateFL/FR
 nonanal diethyl acetalFL/FR
 nonanolFL/FR
 ocean propanal / methyl anthranilate schiff's baseFR
 orange peel oil bitter terpenelessFL/FR
 orangeflower absoluteFL/FR
 petitgrain bigarade oilFL/FR
 phenethyl acetateFL/FR
 phenethyl anthranilateFL/FR
 phenethyl phenyl acetateFL/FR
 phenethyl salicylateFL/FR
 phenyl acetaldehydeFL/FR
 phenyl acetaldehyde digeranyl acetalFR
 phenyl acetic acidFL/FR
 propyl anthranilateFL/FR
laevo-rose oxideFL/FR
 strawberry glycidate 2FL/FR
 styralyl propionateFL/FR
 surfleurs d'oranger oilFL/FR
alpha-terpinyl anthranilateFL/FR
alpha-terpinyl methyl etherFL/FR
 tonka ketoneFR
2,5,9-trimethyl-4,9-decadien-1-alFR
 undecanalFL/FR
(E)-2-undecen-1-olFL/FR
2-undecen-1-olFL/FR
 wallflower absoluteFR
potential uses :
 floral
natural occurrence in :    note
 not found in nature  

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