cinnamyl salicylate 71607-53-9

cinnamyl salicylate

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IUPAC name :

[(E)-3-phenylprop-2-enyl] 2-hydroxybenzoate

InChI :

InChI=1/C16H14O3/c17-15-11-5-4-10-14(15)16(18)19-12-6-9-13-7-2-1-3-8-13/h1-11,17H,12H2/b9-6+

InChIKey :

BQLBAKUNQYHLCM-RMKNXTFCBR

SMILES :

C1=CC=C(C=C1)\C=C\COC(=O)C2=CC=CC=C2O

cas number :	71607-53-9
(EINECS) number :	275-694-3
molar refractivity :	75.36 ± 0.3 cm3
parachor :	565.4 ± 4.0 cm3
index of refraction :	1.632 ± 0.02
surface tension :	51.4 ± 3.0 dyne/cm
density :	1.204 ± 0.06 g/cm3
polarizability :	29.87 ± 0.5 10-24cm3
XlogP :	4.80
molecular weight :	254.2805600
formula :	C16 H14 O3
NMR Predictor :	Predict

export tariff code :

unspecified

fda reg :

unspecified

organoleptics :

properties :

assay :

98.00 to 100.00 %

Food Chemicals Codex Listed :

boiling point :

423.00 to 424.00 °C. @ 760.00 mm Hg

flash point :

355.00 °F. TCC ( 179.44 °C. )

logP (o/w) :

4.60

safety :

most important hazard(s) :

N - Dangerous for the environment.

R 50/53 - Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
S 02 - Keep out of the reach of children.
S 61 - Avoid release to the environment. Refer to special instructions/safety data sheet.

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

Inhalation Toxicity(LC50) :

Not determined

safety in use :

safety references :

EPI System :

view

WGK Germany :

[(E)-3-phenylprop-2-enyl] 2-hydroxybenzoate