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

4-isopropyl quinoline
quinoline, isopropyl-

Supplier Sponsors

CAS Number: 1333-53-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:215-595-4
Nikkaji Web:J561.518F
XlogP3:3.40 (est)
Molecular Weight:171.24261000
Formula:C12 H13 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:pale yellow to yellow clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 277.00 to 279.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.007000 mmHg @ 25.00 °C. (est)
Vapor Density:>1 ( Air = 1 )
Flash Point: 238.00 °F. TCC ( 114.44 °C. )
logP (o/w): 3.330 (est)
Soluble in:
 alcohol
 water, 51.26 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: green
Odor Strength:medium ,
recommend smelling in a 1.00 % solution or less
green metallic earthy leafy
Odor Description:at 1.00 % in dipropylene glycol. green metallic earthy leafy
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
BOC Sciences
For experimental / research use only.
Quinoline,(1-methylethyl)-
 
Safety Information:
European information :
Most important hazard(s):
T - Toxic.
R 22 - Harmful if swallowed.
R 38 - Irritating to skin.
S 02 - Keep out of the reach of children.
S 20/21 - When using do not eat, drink or smoke.
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.
 
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 940 mg/kg
Food and Cosmetics Toxicology. Vol. 13, Pg. 821, 1975.

Dermal Toxicity:
skin-rabbit LD50 160 mg/kg
Food and Cosmetics Toxicology. Vol. 13, Pg. 821, 1975.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for 4-isopropyl quinoline usage levels up to:
  0.2000 % in the fragrance concentrate.
 
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):1333-53-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :74004
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 2810
WGK Germany:3
4-propan-2-ylquinoline
Chemidplus:0001333535
 
References:
 4-propan-2-ylquinoline
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:1333-53-5
Pubchem (cid):74004
Pubchem (sid):135032860
 
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
aldehydic
fresh carbaldehyde
FR
iso
freshal
FR
alliaceous
dipropyl disulfide
FL/FR
balsamic
propyl cinnamate
FL/FR
tetrahydrofurfuryl cinnamate
FL/FR
citrus
lime oil fractions
FR
petitgrain combava oil
FR
fatty
(E)-2-
octenal
FL/FR
floral
anisyl propanal / methyl anthranilate schiff's base
FR
cyclohexyl salicylate
FR
dimethyl benzyl carbinol
FL/FR
floral pyran
FR
hyacinth ether
FR
linalool oxide
FL/FR
ocean propanal / methyl anthranilate schiff's base
FR
octyl acetate
FL/FR
bitter
orangeflower absolute morocco
FL/FR
phenethyl butyl ether
FR
phenyl acetaldehyde diisobutyl acetal
FL/FR
2-
phenyl propyl acetate
FL/FR
fruity
ethyl 3-hexenoate
FL/FR
(E)-2-
hexen-1-ol
FL/FR
2-
hexen-1-ol
FL/FR
green
acetaldehyde butyl phenethyl acetal
FL/FR
acetaldehyde ethyl phenethyl acetal
FL/FR
2-iso
butyl thiazole
FL/FR
cumin acetaldehyde
FL/FR
diphenyl oxide
FL/FR
galbanum absolute replacer
FR
galbanum oleoresin
FL/FR
geranium absolute
FL/FR
green ether
FL/FR
1-
hepten-3-ol
FL/FR
(E)-2-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl lactate
FL/FR
(Z)-3-
hexen-1-yl octanoate
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
hexyl heptanoate
FL/FR
3,6-
ivy carbaldehyde
FL/FR
2,4-
ivy carbaldehyde
FL/FR
ivy dioxolane
FR
leafy acetal
FL/FR
methyl heptine carbonate
FL/FR
(E,Z)-2,6-
nonadien-1-yl acetate
FL/FR
octanal dimethyl acetal
FL/FR
(Z)-5-
octen-1-yl propionate
FL/FR
iso
propyl phenyl propionaldehyde
FR
iso
propyl quinoline
FR
rose leaf absolute (rosa centifolia)
FL/FR
herbal
herbal heptane
FR
6-
hydroxydihydrotheaspirane (mixture of isomers)
FL/FR
lovage tincture
FL/FR
rosemary oleoresin
FL/FR
minty
iso
pulegyl formate
FL/FR
sulfurous
cassis pentanone
FL/FR
3-(
methyl thio) hexanol
FL/FR
waxy
allyl nonanoate
FL/FR
cyclododecyl acetate
FR
woody
1,3,5,7-
undecatetraene
FL/FR
For Flavor
No flavor group found for these
benzyl disulfide
FL
epoxy-2-decenal
FL
2-
hexenal
FL
hexyl heptanoate
FL/FR
3-
methyl-3-pentanol
FL
2-
phenyl propyl acetate
FL/FR
2-iso
propyl pyridine
FL
iso
pulegyl formate
FL/FR
tetrahydrofurfuryl cinnamate
FL/FR
1,3,5,7-
undecatetraene
FL/FR
alliaceous
alliaceous
dipropyl disulfide
FL/FR
aromatic
leafy acetal
FL/FR
camphoreous
6-
hydroxydihydrotheaspirane (mixture of isomers)
FL/FR
fatty
(E)-2-
octenal
FL/FR
floral
bitter
orangeflower absolute morocco
FL/FR
fruity
ethyl 3-hexenoate
FL/FR
2-
hexen-1-ol
FL/FR
propyl cinnamate
FL/FR
green
acetaldehyde butyl phenethyl acetal
FL/FR
acetaldehyde ethyl phenethyl acetal
FL/FR
2-iso
butyl thiazole
FL/FR
cassis pentanone
FL/FR
cumin acetaldehyde
FL/FR
diphenyl oxide
FL/FR
galbanum oleoresin
FL/FR
geranium absolute
FL/FR
green ether
FL/FR
1-
hepten-3-ol
FL/FR
(E)-2-
hexen-1-ol
FL/FR
(E)-2-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl lactate
FL/FR
(Z)-3-
hexen-1-yl octanoate
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
3,6-
ivy carbaldehyde
FL/FR
2,4-
ivy carbaldehyde
FL/FR
linalool oxide
FL/FR
methyl heptine carbonate
FL/FR
(E,Z)-2,6-
nonadien-1-yl acetate
FL/FR
octanal dimethyl acetal
FL/FR
(Z)-5-
octen-1-yl propionate
FL/FR
phenyl acetaldehyde diisobutyl acetal
FL/FR
rose leaf absolute (rosa centifolia)
FL/FR
herbal
lovage tincture
FL/FR
rosemary oleoresin
FL/FR
medicinal
dimethyl benzyl carbinol
FL/FR
metallic
3-(
methyl thio) hexanol
FL/FR
onion
methyl propyl trisulfide
FL
sulfurous
methyl benzyl disulfide
FL
waxy
allyl nonanoate
FL/FR
octyl acetate
FL/FR
 
Potential Uses:
FRacacia
FRagrumen aldehyde
FRalgae
FRamaryllis
FRapple green apple
FLartichoke
FL/FRasafoetida
FLasparagus
FRavocado
FRbasil oil replacer
FRboxwood
FRboxwood blossom
FRboxwood berry
FL/FRcajeput
FLcarrot
FL/FRcarrot seed
FRcelery
FL/FRcilantro
FRclematis
FRcognac
FRcortex
FRcostus
FRcucumber
FL/FRcurrant bud absolute replacer
FRdaffodil
FRelemi
FRevergreen
FRfennel
FRfern
FRfig
 fir
FRfir balsam
FRfoliage
FRgalbanum
FRgeranium
 grass
FRgreen
FRgreen grass
FRgreen leaf
FRguava
FRhop
FRhyacinth
FRhydrangea
FRivy
FRjonquil
 leaf
FLlettuce
 liverwort
FRlotus
FL/FRmarjoram
FRmimosa
FRnarcissus
FRoregano
FRpansy
FL/FRparsley leaf
FLpea green pea
FLpear prickly pear
FLpepper bell pepper
FL/FRpine scotch pine
FRprivet
FRprivet blossom
FRreseda
FRrhubarb
FRroot beer
FRrose geranium
FL/FRrose leaf
 stem
 strawberry leaf
FLtomato
FRtomato leaf
FL/FRvalerian
FLvegetable
 vegetation tropical hothouse vegetation
 vine
FRviolet leaf
 weedy
FRwintergreen
FRwormwood oil replacer
FRyew
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 lichenol
(1-methyl ethyl) quinoline
(1-methylethyl) quinoline
4-propan-2-ylquinoline
p-isopropyl quinoline
para-isopropyl quinoline
4-isopropylquinoline
p-isopropylquinoline
para-isopropylquinoline
 quinoline, (1-methylethyl)-
 quinoline, isopropyl-
 

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