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

citral / methyl anthranilate schiff's base
methyl 2-((3,7-dimethyl-2,6-octadienylidene)amino)benzoate

Supplier Sponsors

Name:methyl 2-[[(2E)-3,7-dimethylocta-2,6-dienylidene]amino]benzoate
CAS Number: 67801-47-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:267-168-7
FDA UNII:55494K367R
Nikkaji Web:J60.474G
XlogP3-AA:4.70 (est)
Molecular Weight:285.38671000
Formula:C18 H23 N O2
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
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Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:dark brown viscous liquid to solid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.00330 to 1.01010 @ 25.00 °C.
Pounds per Gallon - (est).: 8.348 to 8.405
Refractive Index:1.52590 to 1.53370 @ 20.00 °C.
Boiling Point: 413.00 to 414.00 °C. @ 760.00 mm Hg
Flash Point:> 200.00 °F. TCC ( > 93.33 °C. )
logP (o/w): 6.485 (est)
Soluble in:
 alcohol
 water, 0.3433 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: citrus
Odor Strength:medium ,
recommend smelling in a 50.00 % solution or less
Substantivity:260 hour(s) at 100.00 %
fresh sweet lemon orangeflower fruity
Odor Description:at 50.00 % in dipropylene glycol. fresh sweet lemon orangeflower fruity
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Augustus Oils
Citral – Ma Schiff Base
Services
BOC Sciences
For experimental / research use only.
Methyl 2-[(3,7-dimethyl-2,6-octadienylidene)amino]benzoate
 
Safety Information:
 
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
 
Safety in Use Information:
Category: fragrance agents
IFRA Critical Effect: Sensitization
IFRA fragrance material specification:
 The IFRA Scientific Committee examined the physicochemical properties of Schiff bases and concluded that, based on the available information, these materials should be considered under contributions from other sources. By default, the stoichiometric presence of the aldehydes of the Schiff bases is taken into account assuming 100% dissociation. An indicative list of Schiff bases incorporating aldehydes covered by an IFRA Standard of restriction is reported at page 2. These Schiff bases must be taken into account for determination of the maximum use level of the respective aldehydes.
Recommendation for citral / methyl anthranilate schiff's base usage levels up to:
  4.0000 % in the fragrance concentrate.
 
Recommendation for citral / methyl anthranilate schiff's base flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):67801-47-2
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :6437138
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
methyl 2-[[(2E)-3,7-dimethylocta-2,6-dienylidene]amino]benzoate
Chemidplus:0067801472
 
References:
 methyl 2-[[(2E)-3,7-dimethylocta-2,6-dienylidene]amino]benzoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:67801-47-2
Pubchem (cid):6437138
Pubchem (sid):135063862
 
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
No odor group found for these
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-one
FL/FR
aldehydic
aldehydic
(Z)-4-
dodecenal
FL/FR
2-
methyl undecanal dimethyl acetal
FR
balsamic
benzyl cinnamate
FL/FR
cinnamyl formate
FL/FR
camphoreous
fenchol
FL/FR
citrus
acetaldehyde citronellyl methyl acetal
FR
aldehydic nitrile
FR
beta-
bisabolol
FL/FR
cedrat peel oil
FL/FR
citral
FL/FR
citral diethyl acetal
FL/FR
citral dimethyl acetal
FL/FR
citral ethylene glycol acetal
FR
citral propylene glycol acetal
FL/FR
citronella oil ceylon
FL/FR
citronellyl nitrile
FR
(Z)-4-
decenal
FL/FR
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-yl acetate
FL/FR
homo
geranyl nitrile
FR
2-
heptanol
FL/FR
lemon hexadiene
FL/FR
lemon oil c.p. california
FL/FR
lemon oil c.p. furocoumarin reduced
FL/FR
lemon oil italy
FL/FR
lemon oil terpeneless
FL/FR
lemongrass oil
FL/FR
lemongrass oil guatemala
FL/FR
lemongrass oil morocco
FL/FR
litsea cubeba fruit oil
FL/FR
litsea cubeba oil terpeneless
FL/FR
methyl heptenone
FL/FR
(Z+E)-2-
methyl-2-(4-methyl-3-pentenyl) cyclopropane carbaldehyde
FL/FR
neroli ketone
FR
ocimenol
FL/FR
petitgrain combava oil
FR
alpha-
terpinyl methyl ether
FL/FR
tetrahydrocitral
FL/FR
trimethyl cyclohexene
FR
verbena oil spain
FL/FR
verbena oil terpeneless
FL/FR
clean
clean nitrile
FR
coumarinic
tonka ketone
FR
fatty
butyl undecylenate
FL/FR
fermented
methyl decanoate
FL/FR
floral
acetal 318
FR
acetyl tetralin
FR
iso
amyl angelate
FL/FR
alpha-
amyl cinnamaldehyde
FL/FR
alpha-
amyl cinnamaldehyde dimethyl acetal
FL/FR
iso
amyl geranate
FR
benzyl acetate
FL/FR
benzyl acetoacetate
FL/FR
benzyl formate
FL/FR
champaca absolute
FR
citronellyl butyrate
FL/FR
citronellyl hexanoate
FL/FR
citronellyl propionate
FL/FR
(E)-
citronellyl tiglate
FL/FR
cyclamen aldehyde / methyl anthranilate schiff's base
FR
decanal / methyl anthranilate schiff's base
FR
decyl formate
FR
dihydrojasmone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
ethyl anthranilate
FL/FR
geraniol
FL/FR
honeysuckle absolute
FR
hydroxycitronellal / methyl anthranilate schiff's base
FR
leerall / methyl anthranilate schiff's base
FR
lemon oil distilled
FL/FR
lilyall / methyl anthranilate schiff's base
FR
linalyl anthranilate
FL/FR
menthadienyl formate
FR
methoxymelonal
FL/FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
alpha-iso
methyl ionone (90% min.)
FL/FR
methyl ionyl acetate
FL/FR
beta-
naphthyl methyl ketone
FL/FR
alpha-
naphthyl methyl ketone
FL/FR
neroli oil bigarde
FL/FR
neroli oil CO2 extract
FL/FR
nerolin fragarol
FL/FR
neryl isovalerate
FL/FR
nonanal / methyl anthranilate schiff's base
FR
3-
nonanon-1-yl acetate
FL/FR
ocean propanal / methyl anthranilate schiff's base
FR
petitgrain bigarade oil
FL/FR
petitgrain lemon oil
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl isovalerate
FL/FR
phenyl amyl alcohol
FL/FR
1-
phenyl propyl butyrate
FL/FR
2-
phenyl propyl isobutyrate
FL/FR
4-
phenyl-3-buten-2-ol
FL/FR
propyl anthranilate
FL/FR
iso
propyl benzoate
FL/FR
rose undecene
FR
alpha-
terpinyl anthranilate
FL/FR
terpinyl formate
FL/FR
terpinyl valerate
FL/FR
tetrahydroionyl acetate
FR
(E)-2,5,9-
trimethyl-4,9-decadien-1-al
FR
wallflower absolute
FR
fruity
amyl heptanoate
FL/FR
benzaldehyde / methyl anthranilate schiff's base
FR
berry hexanoate
FR
iso
butyl anthranilate
FL/FR
iso
butyl furyl propionate
FL/FR
citronellyl isobutyrate
FL/FR
cyclohexyl anthranilate
FL/FR
(Z)-beta-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
beta-
damascone
FL/FR
ethyl isobutyrate
FL/FR
ethyl levulinate
FL/FR
heptanal cyclic ethylene acetal
FR
heptyl isobutyrate
FL/FR
3-
mercaptohexyl acetate
FL/FR
methyl (Z)-3-hexenoate
FL/FR
methyl anthranilate
FL/FR
methyl dimethyl anthranilate
FL/FR
methyl isobutyrate
FL/FR
(E)-7-
methyl-3-octen-2-one
FL/FR
rhubarb pyran
FR
4-(para-
tolyl)-2-butanone
FL/FR
tropical ionone
FL/FR
green
iso
amyl 3-(2-furan) propionate
FL/FR
citrus carbaldehyde / methyl anthranilate schiff's base
FR
iso
decanal
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
hexoxyacetaldehyde dimethyl acetal
FR
nerol oxide
FL/FR
herbal
canarium luzonicum gum
FL/FR
canarium luzonicum oil
FL/FR
chamomile isobutyrate
FR
chamomile propionate
FR
chamomile valerate
FR
clary propyl acetate
FR
methyl cyclogeranate (Firmenich)
FR
rue oil
FL/FR
rue oil cuba
FL/FR
naphthyl
beta-
naphthyl ethyl ether
FL/FR
beta-
naphthyl methyl ether
FL/FR
powdery
alpha-
methyl ionone
FL/FR
spicy
para-
anisyl formate
FL/FR
terpenic
elemi resinoid
FL/FR
gamma-
terpinene
FL/FR
woody
2-
decalinyl acetate
FR
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-ol
FL/FR
labdanum ethanone
FR
alpha-
terpinene
FL/FR
For Flavor
No flavor group found for these
iso
amyl angelate
FL/FR
alpha-
amyl cinnamaldehyde dimethyl acetal
FL/FR
cedrat peel oil
FL/FR
citral propylene glycol acetal
FL/FR
beta-
cubebene
FL
iso
decanal
FL/FR
dihydronootkatone
FL
S-(2,5-
dimethyl-3-furyl) ethane thioate
FL
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-ol
FL/FR
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-one
FL/FR
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-yl acetate
FL/FR
(Z)-4-
dodecenal
FL/FR
4-
mercapto-4-methyl-2-pentanol
FL
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
methyl dimethyl anthranilate
FL/FR
(Z+E)-2-
methyl-2-(4-methyl-3-pentenyl) cyclopropane carbaldehyde
FL/FR
alpha-
naphthyl methyl ketone
FL/FR
ocimenol
FL/FR
phenyl amyl alcohol
FL/FR
1-
phenyl propyl butyrate
FL/FR
2-
phenyl propyl isobutyrate
FL/FR
propyl anthranilate
FL/FR
iso
propyl benzoate
FL/FR
alpha-
terpinyl anthranilate
FL/FR
tetrahydrocitral
FL/FR
iso
amyl 3-(2-furan) propionate
FL/FR
benzyl acetoacetate
FL/FR
iso
butyl furyl propionate
FL/FR
beta-
damascone
FL/FR
berry
berry
heptyl isobutyrate
FL/FR
burnt
ethyl 2-furoate
FL
camphoreous
fenchol
FL/FR
citrus
beta-
bisabolol
FL/FR
citral
FL/FR
citral diethyl acetal
FL/FR
citral dimethyl acetal
FL/FR
citronella oil ceylon
FL/FR
(Z)-4-
decenal
FL/FR
lemon hexadiene
FL/FR
lemon oil c.p. california
FL/FR
lemon oil c.p. furocoumarin reduced
FL/FR
lemon oil distilled
FL/FR
lemon oil italy
FL/FR
lemon oil terpeneless
FL/FR
lemongrass oil
FL/FR
lemongrass oil guatemala
FL/FR
lemongrass oil morocco
FL/FR
litsea cubeba fruit oil
FL/FR
petitgrain bigarade oil
FL/FR
petitgrain lemon oil
FL/FR
verbena oil france
FL
verbena oil spain
FL/FR
verbena oil terpeneless
FL/FR
ethereal
ethyl isobutyrate
FL/FR
methyl isobutyrate
FL/FR
fatty
methyl decanoate
FL/FR
(E)-7-
methyl-3-octen-2-one
FL/FR
floral
citronellyl hexanoate
FL/FR
citronellyl propionate
FL/FR
dihydrojasmone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
geraniol
FL/FR
linalyl anthranilate
FL/FR
alpha-iso
methyl ionone (90% min.)
FL/FR
beta-
naphthyl methyl ketone
FL/FR
neroli oil bigarde
FL/FR
neroli oil CO2 extract
FL/FR
tropical ionone
FL/FR
fruity
amyl heptanoate
FL/FR
benzyl acetate
FL/FR
benzyl formate
FL/FR
iso
butyl anthranilate
FL/FR
citronellyl butyrate
FL/FR
citronellyl isobutyrate
FL/FR
cyclohexyl anthranilate
FL/FR
(Z)-beta-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
ethyl anthranilate
FL/FR
ethyl levulinate
FL/FR
2-
heptanol
FL/FR
2-
hexyl-4-acetoxytetrahydrofuran
FL
methoxymelonal
FL/FR
methyl (Z)-3-hexenoate
FL/FR
methyl 4-phenyl butyrate
FL
methyl anthranilate
FL/FR
alpha-
methyl ionone
FL/FR
nerolin fragarol
FL/FR
neryl isovalerate
FL/FR
3-
nonanon-1-yl acetate
FL/FR
phenethyl isovalerate
FL/FR
2-
phenyl-4-pentenal
FL
terpinyl formate
FL/FR
terpinyl valerate
FL/FR
4-(para-
tolyl)-2-butanone
FL/FR
green
canarium luzonicum gum
FL/FR
canarium luzonicum oil
FL/FR
(E)-
citronellyl tiglate
FL/FR
elemi resinoid
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
methyl heptenone
FL/FR
nerol oxide
FL/FR
herbal
rue oil
FL/FR
rue oil cuba
FL/FR
honey
phenethyl isobutyrate
FL/FR
lemon
litsea cubeba oil terpeneless
FL/FR
naphthyl
beta-
naphthyl methyl ether
FL/FR
powdery
beta-
naphthyl ethyl ether
FL/FR
spicy
para-
anisyl formate
FL/FR
benzyl cinnamate
FL/FR
cinnamyl formate
FL/FR
terpenic
gamma-
terpinene
FL/FR
alpha-
terpinene
FL/FR
tropical
alpha-
amyl cinnamaldehyde
FL/FR
3-
mercaptohexyl acetate
FL/FR
waxy
butyl undecylenate
FL/FR
4-
phenyl-3-buten-2-ol
FL/FR
woody
methyl ionyl acetate
FL/FR
alpha-
terpinyl methyl ether
FL/FR
 
Potential Uses:
FRcitrus
FRlemon
FRlime
FRorange
 topnotes
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 benzoic acid, 2-((3,7-dimethyl-2,6-octadienylidene)amino)-, methyl ester
N-(3,7-dimethyl-2,6-octadienylidene) anthranilic acid methyl ester
 methyl 2-((3,7-dimethyl-2,6-octadienylidene)amino) benzoate
 methyl 2-((3,7-dimethyl-2,6-octadienylidene)amino)benzoate
 methyl 2-[[(2E)-3,7-dimethylocta-2,6-dienylidene]amino]benzoate
 methyl anthranilate / citral schiff's base
 

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