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| IUPAC name : | pentyl 2-methylpropanoate |
| InChI : | InChI=1/C9H18O2/c1-4-5-6-7-11-9(10)8(2)3/h8H,4-7H2,1-3H3 |
| InChIKey : | UYGGIIOLYXRSQY-UHFFFAOYAE |
| SMILES : | CCCCCOC(=O)C(C)C |
| (EINECS) number : | 219-494-6 |
| cas number : | 2445-72-9 |
| coe number : | 293 |
| fl. number : | 09.418 |
| molar refractivity : | 45.47 ± 0.3 cm3 |
| parachor : | 412.3 ± 4.0 cm3 |
| index of refraction : | 1.416 ± 0.02 |
| surface tension : | 26.9 ± 3.0 dyne/cm |
| density : | 0.874 ± 0.06 g/cm3 |
| polarizability : | 18.02 ± 0.5 10-24cm3 |
| xlogp : | 2.70 |
| molecular weight : | 158.2380200 |
| formula : | C9 H18 O2 |
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| fda reg : | unspecified |
h. number : | 2915.60.0000 |
| organoleptics : | |
| odor type : | fruity |
| odor strength : | medium |
odor description :
at 100.00 %. | fruity apple banana apricot |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 176.00 - 177.00 °C. @ 760.00 mm Hg
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| logp : | 3.18 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 139.00 °F. TCC ( 59.44 °C. )
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| recommendation for amyl isobutyrate usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
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| safety links : | |
| (EINECS) number : | 219-494-6 |
| chemidplus : | 002445729 |
| epa-srs : | 2445-72-9 |
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| other : | |
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| references : | |
| pubchem : | 217774 |
| NIST Chemistry WebBook : | 3788323581 |
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