benzyl anthranilate
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IUPAC name :benzyl 2-aminobenzoate
InChI :InChI=1/C14H13NO2/c15-13-9-5-4-8-12(13)14(16)17-10-11-6-2-1-3-7-11/h1-9H,10,15H2
InChIKey :ZHZPDMZPDWXVMJ-UHFFFAOYAO
SMILES :C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2N
cas number :82185-41-9
(EINECS) number :279-911-2
molar refractivity :66.74 ± 0.3 cm3
parachor :510.1 ± 4.0 cm3
index of refraction :1.618 ± 0.02
surface tension :51.6 ± 3.0 dyne/cm
density :1.194 ± 0.06 g/cm3
polarizability :26.46 ± 0.5 10-24cm3
XlogP : 3.30
XlogP3 : 3.40
molecular weight : 227.2585200 (IUPAC)
formula :C14 H13 N O2
NMR Predictor :Predict
 
 
export tariff code :2922.49.3800
fda reg :unspecified

Suppliers :
Nanjing :benzyl anthranilate

organoleptics :
odor type :citrus
odor strength :medium
odor description :
at 100.00 %.  
floral grapefruit lily

properties :
appearence :pale yellow to yellow clear liquid to solid
assay : 96.00 to 100.00 %   
Food Chemicals Codex Listed :No
melting point : 76.00 to 78.00 °C. @ 760.00 mm Hg
boiling point : 374.00 to 375.00 °C. @ 760.00 mm Hg
flash point :> 200.00  °F.  TCC  ( > 93.33 °C. )
logP (o/w) : 3.81

safety :
most important hazard(s) :Xi - Irritant
  R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
 
recommendation for benzyl anthranilate usage levels up to :
  3.0000 % in the fragrance concentrate.

safety references :
EPI System :view
Canada Domestic Sub. List :Yes
 
WGK Germany :3
 
 
 
 benzyl 2-aminobenzoate
(EINECS) number :279-911-2
chemidplus :082185419
EPA Substance Registry Services :82185-41-9

references :
 benzyl 2-aminobenzoate
NIST Chemistry WebBook :2743428417
pubchem :3888841

other :
synonyms :
2-aminobenzoic acid phenylmethyl ester
 benzyl 2-aminobenzoate
 phenylmethyl 2-aminobenzoate

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) blends with :
6-acetoxydihydrotheaspirane
 acetyl tetralin
alpha-amyl cinnamaldehyde dimethyl acetal
alpha-butyl cinnamaldehyde
isobutyl methyl anthranilate
 cassis oxime 10%
 champaca absolute
 citral / methyl anthranilate schiff's base
 citronellyl ethoxalate
 citronellyl oxyacetaldehyde
 citrus ocimenol
 clean nitrile
para-cresyl isobutyrate
para-cresyl phenyl acetate
para-cresyl propionaldehyde
 cumin carbinol
 cyclamen aldehyde / methyl anthranilate schiff's base
 cyclamen homoaldehyde
 cyclohexyl anthranilate
 cyclohexyl ethyl alcohol
 cyclohexyl propanol
2-decalinol
 decanal / methyl anthranilate schiff's base
(Z)-4-decen-1-al
 decyl formate
 dehydronootkatone
 dihydronootkatone
 dimethyl benzyl carbinyl formate
2,4-dimethyl-3-cyclohexene-1-methanyl acetate
(E,E)-2,4-dodecadien-1-al
 ethyl anthranilate
 ethyl linalyl acetal
(E,E)-farnesol
 floral butanal
 floral pyranol
 freesia acetate
 gardenia amide
 gardenia decalone
 gardenia pentyl acetate
 grapefruit acetal
 grapefruit indene
 grapefruit menthane
 grapefruit nitrile
 grapefruit octenone
 grapefruit oil
 grapefruit oil c.p.
 grapefruit oil CO2 extract
 grapefruit oil terpeneless
 grapefruit pentanol
 hawthorn ethanol
 honeysuckle absolute
 hydroxycitronellal
 hydroxycitronellal / methyl anthranilate schiff's base
 hydroxycitronellal diethyl acetal
 hydroxycitronellal dimethyl acetal
 hydroxycitronellol
 jasimia
 labdanum ethanone
 leerall
 leerall / methyl anthranilate schiff's base
 lily pentanal
 lily propanol
 lilyall
 lilyall / methyl anthranilate schiff's base
 linalyl anthranilate
 linalyl benzoate
 linalyl cinnamate
 linalyl propionate
 magnolia cyclohexanol
 magnolia decadienal
 magnolia indene
1-para-menthene-8-thiol
4-mercapto-4-methyl-2-pentanol
 methoxycitronellal
 methyl anthranilate
alpha-methyl naphthyl ketone
2-methyl octanal
 muguet butanal
 muguet butanol
 muguet carbaldehyde
 muguet carbinol
 muguet carboxaldehyde
 muguet ethanol
 muguet nitrile
 muguet octadienol
 muguet propanol
 muguet shiseol
 muguet undecadienal
 myrmac aldehyde
beta-naphthyl ethyl ether
beta-naphthyl methyl ether
beta-naphthyl methyl ketone
2-naphthyl phenyl ketone
 nerol oxide
 neroli oil
 neroli oil CO2 extract
 nerolin fragarol
 neryl acetate
 nonanal
 nonanal / methyl anthranilate schiff's base
 nootkatone
 ocean propanal / methyl anthranilate schiff's base
3-octyl acetate
 orangeflower absolute
 ozone propanal
 peony acetonitrile
 petitgrain bigarade oil
 phenyl glycol diacetate
 propyl anthranilate
 rhubarb furan
 surfleurs d'oranger oil
alpha-terpinyl anthranilate
alpha-terpinyl methyl ether
 tetrahydrolinalool
 tetrahydromyrcenol
 tonka ketone
 tridecanal
(±)-2,4,8-trimethyl-7-nonen-2-ol
 valencene
 wallflower absolute
 ylang ylang oil
 ylang ylang oil CO2 extract

(odor and/or flavor) used in :
 citrus
 floral
 flower
 grapefruit
 jasmin
 mandarin
 petitgrain

natural occurrence in :
not found in nature



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