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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (4-methylphenyl) acetate |
| InChI : | InChI=1/C9H10O2/c1-7-3-5-9(6-4-7)11-8(2)10/h3-6H,1-2H3 |
| InChIKey : | CDJJKTLOZJAGIZ-UHFFFAOYAR |
| SMILES : | CC1=CC=C(C=C1)OC(=O)C |
| (EINECS) number : | 205-413-1 |
| cas number : | 140-39-6 |
| beilstein number : | 1908125 |
| fema number : | 3073 |
| coe number : | 226 |
| jecfa number : | 699 |
| fl. number : | 09.036 |
| molar refractivity : | 42.41 ± 0.3 cm3 |
| parachor : | 346.4 ± 4.0 cm3 |
| index of refraction : | 1.503 ± 0.02 |
| surface tension : | 34.1 ± 3.0 dyne/cm |
| density : | 1.047 ± 0.06 g/cm3 |
| polarizability : | 16.81 ± 0.5 10-24cm3 |
| xlogp : | 2.20 |
| molecular weight : | 150.1745000 |
| formula : | C9 H10 O2 |
| BioActivity Analysis : | 97700 |
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| fda reg : | 172.515 |
h. number : | 2916.35.1500 |
| organoleptics : | |
| odor type : | floral |
| odor strength : | high ,
recommend smelling in a 1.00 % solution or less |
odor description :
at 1.00 % in dipropylene glycol. | narcissus phenolic animal |
| substantivity : | 36 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | Yes |
| specific gravity : | 1.03200 - 1.04000 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.587 to 8.654
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| specific gravity : | 1.03300 - 1.04100 @ 20.00 °C.
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| pounds per gallon - calc. : | 8.606 to 8.672
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| refractive index : | 1.50000 - 1.50500 @ 20.00 °C.
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| boiling point : | 210.00 - 211.00 °C. @ 760.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| logp : | 2.11 |
| shelf life : | 24.00 month(s) or longer if stored properly. |
| storage : | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| safety : | |
| most important hazard(s) : |
Xn - Harmful. |
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| Oral Toxicity(LD50) : |
Oral-Rat 1900.00 mg/kg
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| Dermal Toxicity(LD50) : |
Skin-Rabbit 2100.00 mg/kg
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| flash point ( Deg. F. ) : | 194.00 °F. TCC ( 90.00 °C. )
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| recommendation for para-cresyl acetate usage levels up to : |
| | 4.0000 % in the fragrance concentrate.
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| recommendation for para-cresyl acetate usage levels up to : |
| | 220.0000 ppm in the flavor.
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| safety links : | |
| msds : | msds |
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| (EINECS) number : | 205-413-1 |
| rtecs : | AJ7569000 for 140-39-6 |
| chemidplus : | 000140396 |
| epa-srs : | 140-39-6 |
| dtp/nci : | 43244 |
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| other : | |
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C of A
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| references : | |
| pubchem : | 151949 |
| NIST Chemistry WebBook : | 2992273995 |
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