isopropyl anthranilate
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IUPAC name :propan-2-yl 2-aminobenzoate
InChI :InChI=1/C10H13NO2/c1-7(2)13-10(12)8-5-3-4-6-9(8)11/h3-7H,11H2,1-2H3
InChIKey :XKOZHFJYXAQZJX-UHFFFAOYAM
SMILES :CC(C)OC(=O)C1=CC=CC=C1N
cas number :18189-02-1
(EINECS) number :242-074-9
molar refractivity :51.48 ± 0.3 cm3
parachor :414.9 ± 4.0 cm3
index of refraction :1.544 ± 0.02
surface tension :41.9 ± 3.0 dyne/cm
density :1.099 ± 0.06 g/cm3
polarizability :20.41 ± 0.5 10-24cm3
XlogP : 2.50
molecular weight : 179.2157200
formula :C10 H13 N O2
NMR Predictor :Predict
 
 
export tariff code :2922.49.3800
fda reg :unspecified

organoleptics :
odor type :floral
odor strength :medium
odor description :
at 100.00 %.  
neroli hawthorn honey

properties :
appearence :colorless to yellow clear liquid
assay : 95.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 274.00 to 275.00 °C. @ 760.00 mm Hg
vapor pressure :0.00500 mm/Hg @ 25.00 °C.
flash point : 273.00  °F.  TCC  ( 133.89 °C. )
logP (o/w) : 2.92

safety :
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
 
recommendation for isopropyl anthranilate usage levels up to :
  4.0000 % in the fragrance concentrate.

safety references :
EPI System :view
EPA Chem. Sub. Inventory : Yes
 
 
 
 propan-2-yl 2-aminobenzoate
(EINECS) number :242-074-9
chemidplus :018189021
EPA Substance Registry Services :18189-02-1

references :
 propan-2-yl 2-aminobenzoate
pubchem :664330

other :
synonyms :
2-aminobenzoic acid 1-methyl ethyl ester
 propan-2-yl 2-aminobenzoate

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) blends with :
 acetaldehyde dimethyl acetal
 acetophenone
1-acetyl cyclohexyl acetate
 acorn acetate
 allyl phenoxyacetate
 allyl phenyl acetate
isoamyl phenyl acetate
ortho-anisaldehyde
para-anisaldehyde
para-anisaldehyde / methyl anthranilate schiff's base
para-anisaldehyde dimethyl acetal
 anisonitrile
para-anisyl acetaldehyde
para-anisyl alcohol
para-anisyl phenyl acetate
 anisyl propanal / methyl anthranilate schiff's base
 artemisyl ketone
 beeswax absolute
 bigarade oxide
 bran absolute
 butyl phenyl acetate
 cardamom absolute
 carnation absolute
 cassis bud oil
 chamomile flower oil germany
 champaca absolute
 cistus cyclohexanone
 citral / methyl anthranilate schiff's base
 citronellyl anthranilate
 citronellyl isovalerate
 citronellyl oxyacetaldehyde
 citronellyl phenyl acetate
 citronellyl valerate
 clean nitrile
 cocoa butenal
 cocoa pentenal
para-cresyl phenyl acetate
 cyclamen aldehyde / methyl anthranilate schiff's base
 cyclohexyl acetic acid
 cyclohexyl anthranilate
 cyclohexyl phenyl acetate
(E)-beta-damascone
(Z)-beta-damascone
beta-damascone
 decanal / methyl anthranilate schiff's base
 decanal dimethyl acetal
(Z)-4-decen-1-al
 decyl anthranilate
 decyl formate
1,3-dimethoxybenzene
 dimethyl anthranilate
 dimethyl octanyl acetate
2,4-dimethyl-2-pentenoic acid
 dodecanol
 earthy indane
 elder flowers absolute
para-ethyl acetophenone
 ethyl anthranilate
 ethyl ethyl anthranilate
 ethyl hydrocinnamate
 ethyl phenyl acetate
 eugenyl phenyl acetate
isoeugenyl phenyl acetate
 farnesene
 fig leaf absolute
 genet concrete
 geranyl anthranilate
 geranyl formate
 geranyl phenyl acetate
 guaiacyl phenyl acetate
 hawthorn acetate
 hawthorn carbinol
 heliotropyl acetate
(E)-2-hexen-1-yl phenyl acetate
(E)-3-hexenoic acid
 honeysuckle absolute
 hyacinth acetal
4'-hydroxyacetophenone
 hydroxycitronellal / methyl anthranilate schiff's base
 immortelle absolute
 kewda absolute
 kewda oil
 labdanum ethanone
 leerall / methyl anthranilate schiff's base
 lilyall / methyl anthranilate schiff's base
 lime oil distilled terpeneless
 linalyl anthranilate
 linalyl cinnamate
 linalyl phenyl acetate
 methyl (E)-2-hexenoate
 methyl acetophenone
2'-methyl acetophenone
 methyl anthranilate
 methyl butyl phenyl acetate
 methyl hydrocinnamate
alpha-methyl naphthyl ketone
 methyl phenyl acetate
4-methyl-4-phenyl pentanone
beta-naphthyl anthranilate
beta-naphthyl ethyl ether
beta-naphthyl methyl ether
beta-naphthyl methyl ketone
2-naphthyl phenyl ketone
 nerol
 nerol oxide
 neroli oil
 neroli oil CO2 extract
 nerolidyl acetate
 nerolin fragarol
(Z,Z)-3,6-nonadien-1-ol
 nonanal / methyl anthranilate schiff's base
(Z)-6-nonen-1-ol
 ocean propanal / methyl anthranilate schiff's base
(Z)-3-octen-1-yl propionate
 octyl isovalerate
 orangeflower absolute
 osmanthus absolute
 petitgrain bigarade oil
 petitgrain oil
 phenethyl acetate
 phenethyl anthranilate
 phenethyl benzoate
 phenethyl furoate
 phenethyl hexanoate
 phenethyl phenyl acetate
 phenethyl propionate
 phenyl acetaldehyde
 phenyl acetic acid
 phenyl glycol diacetate
(R)-2-phenyl propyl alcohol
2-phenyl propyl alcohol
3-phenyl propyl formate
 phenyl pyruvic acid
(E)-2-phenyl-1(2)-propene-1-yl acetate
 propiophenone
 propyl 4-hydroxybenzoate
 propyl phenyl acetate
isopropyl phenyl acetate
 rhodinyl phenyl acetate
 rose absolute morocco
 rose carboxylate
 rose concrete
 santalyl phenyl acetate
 strawberry glycidate 1
 strawberry glycidate 2
 surfleurs d'oranger oil
alpha-terpinyl anthranilate
alpha-terpinyl methyl ether
1,2,3,4-tetrahydroquinoline
 tonka ketone
 tuberose absolute
 tuberose absolute concrete
 wallflower absolute
 waxy acetate
 ylang ylang oil
 ylang ylang oil CO2 extract
 ylang ylang oil I
 ylang ylang oil II
 ylang ylang oil III

(odor and/or flavor) used in :
 hawthorn
 jasmin
 mandarin
 neroli

natural occurrence in :
not found in nature



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