octanal / methyl anthranilate schiff's base 67801-44-9

octanal / methyl anthranilate schiff's base

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IUPAC name :

methyl 2-(octylideneamino)benzoate

InChI :

InChI=1/C16H23NO2/c1-3-4-5-6-7-10-13-17-15-12-9-8-11-14(15)16(18)19-2/h8-9,11-13H,3-7,10H2,1-2H3/b17-13+

InChIKey :

YHXKDPQWWGRLRC-GHRIWEEIBR

SMILES :

CCCCCCCC=NC1=CC=CC=C1C(=O)OC

cas number :	67801-44-9
(EINECS) number :	267-165-0
molar refractivity :	78.66 ± 0.5 cm3
parachor :	646.8 ± 8.0 cm3
index of refraction :	1.497 ± 0.05
surface tension :	33.7 ± 7.0 dyne/cm
density :	0.97 ± 0.1 g/cm3
polarizability :	31.18 ± 0.5 10-24cm3
XlogP :	5.00
molecular weight :	261.3593200 (IUPAC)
formula :	C16 H23 N O2
NMR Predictor :	Predict

export tariff code :

unspecified

fda reg :

unspecified

Suppliers :

Vigon :

Methyl Anthranilate / Octanal Schiff Base

organoleptics :

odor type :

floral

odor strength :

medium ,
recommend smelling in a 10.00 % solution or less

odor description :¹
at 10.00 % in dipropylene glycol.

fresh floral grape oily fatty

odor sample from :

International Flavors & Fragrances Inc.

substantivity :

400 Hour(s)

properties :

appearence :

yellow to dark yellow slightly viscous liquid

assay :

95.00 to 100.00 %

Food Chemicals Codex Listed :

refractive index :

1.55000 to 1.57000 @ 20.00 °C.

boiling point :

380.00 to 381.00 °C. @ 760.00 mm Hg

flash point :

> 212.00 °F. TCC ( > 100.00 °C. )

logP (o/w) :

5.90

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 :

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

Inhalation Toxicity(LC50) :

Not determined

safety in use :

recommendation for octanal / methyl anthranilate schiff's base usage levels up to :

10.0000 % in the fragrance concentrate.

recommendation for octanal / methyl anthranilate schiff's base usage levels up to :

not for flavor use.

safety references :

EPI System :

view

Canada Domestic Sub. List :

Yes

EPA Chem. Sub. Inventory :

Yes

methyl 2-(octylideneamino)benzoate

(EINECS) number :

267-165-0

chemidplus :

067801449

EPA Substance Registry Services :

67801-44-9

references :

methyl 2-(octylideneamino)benzoate

pubchem :

683076

Cosmetics :

Cosmetic uses :

perfuming agents

other :

reference :

Luebke, William tgsc, (1989)¹

CosIng :

cosmetic data

synonyms :
	aldehyde C-8 / methyl anthranilate schiff's base
	anthranilic acid N-octylidene methyl ester
	methyl 2-(octylidene amino) benzoate
	methyl 2-(octylideneamino)benzoate
	methyl anthranilate / aldehyde C-8 schiff's base
	methyl anthranilate / octanal schiff's base
	ocmea
soluble in :
	alcohol
insoluble in :
	water
(odor and/or flavor) blends with :
	allyl anthranilate
alpha-	amyl cinnamaldehyde / methyl anthranilate schiff's base
	benzyl anthranilate
	benzyl lactate
	butyl anthranilate
iso	butyl anthranilate
iso	butyl methyl anthranilate
	cinnamyl anthranilate
	curacao peel oil
	decanol
(E)-4-	decen-1-al
	decyl anthranilate
	dihydroisojasmonate
	dihydronootkatone
	ethyl 3-hydroxyhexanoate
	ethyl anthranilate
	ethyl propionate
2-	ethyl-1-hexanol
	furfuryl butyrate
	grape butyrate
(Z)-3-	hexen-1-yl anthranilate
	lime oil distilled terpeneless
	methyl anthranilate
	methyl formyl anthranilate
	petitgrain mandarin oil
	woody acetate
(odor and/or flavor) used in :
	citrus
	floral
	fruit
	grape
	herbal
	mandarin
	peony
	tangerine
	tropical
natural occurrence in :
	not found in nature

information only - not sold by The Good Scents Company.

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