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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (2-methylphenyl) 2-methylpropanoate |
| InChI : | InChI=1/C11H14O2/c1-8(2)11(12)13-10-7-5-4-6-9(10)3/h4-8H,1-3H3 |
| InChIKey : | FDJBDZVTTXWIQM-UHFFFAOYAX |
| SMILES : | CC1=CC=CC=C1OC(=O)C(C)C |
| cas number : | 36438-54-7 |
| fema number : | 3753 |
| coe number : | 681 |
| jecfa number : | 700 |
| fl. number : | 09.480 |
| molar refractivity : | 51.64 ± 0.3 cm3 |
| parachor : | 423.3 ± 4.0 cm3 |
| index of refraction : | 1.496 ± 0.02 |
| surface tension : | 32.9 ± 3.0 dyne/cm |
| density : | 1.008 ± 0.06 g/cm3 |
| polarizability : | 20.47 ± 0.5 10-24cm3 |
| xlogp : | 2.60 |
| molecular weight : | 178.2276600 |
| formula : | C11 H14 O2 |
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| fda reg : | unspecified |
h. number : | 2915.60.0000 |
| organoleptics : | |
| odor type : | phenolic |
| odor strength : | high ,
recommend smelling in a 0.10 % solution or less |
odor description :
at 0.10 % in dipropylene glycol. | phenolic berry medical |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.00400 @ 25.00 °C.
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| boiling point : | 107.00 - 108.00 °C. @ 8.00 mm Hg
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| boiling point : | 238.00 - 239.00 °C. @ 760.00 mm Hg
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| logp : | 2.89 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 203.00 °F. TCC ( 95.00 °C. )
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| recommendation for ortho-cresyl isobutyrate usage levels up to : |
| | 0.3000 % in the fragrance concentrate.
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| safety links : | |
| chemidplus : | 036438547 |
| epa-srs : | 36438-54-7 |
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| other : | |
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| references : | |
| pubchem : | 198363 |
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