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| IUPAC name : | prop-2-enyl 2-hydroxybenzoate |
| InChI : | InChI=1/C10H10O3/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h2-6,11H,1,7H2 |
| InChIKey : | YYKBLDCLPBWOOE-UHFFFAOYAP |
| SMILES : | C=CCOC(=O)C1=CC=CC=C1O |
| cas number : | 10484-09-0 |
| (EINECS) number : | 233-992-0 |
| molar refractivity : | 48.89 ± 0.3 cm3 |
| parachor : | 395.7 ± 4.0 cm3 |
| index of refraction : | 1.548 ± 0.02 |
| surface tension : | 43.7 ± 3.0 dyne/cm |
| density : | 1.158 ± 0.06 g/cm3 |
| polarizability : | 19.38 ± 0.5 10-24cm3 |
| XlogP : | 3.20 |
| XlogP3 : | 3.00 |
| molecular weight : | 178.1846000 (IUPAC) |
| formula : | C10 H10 O3 |
| BioActivity Analysis : | 477915 |
| NMR Predictor : | Predict |
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| export tariff code : | 2918.23.0000 |
| fda reg : | unspecified |
Suppliers :
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| Nanjing : | ALLYL SALICYLATE
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organoleptics :
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| odor type : | fruity |
| odor strength : | medium |
odor description : at 100.00 %. | banana pineapple wintergreen |
properties :
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| appearence : | colorless clear liquid |
| assay : | 98.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.10000 @ 15.00 °C.
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| boiling point : | 247.00 to 250.00 °C. @ 760.00 mm Hg
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| boiling point : | 107.00 to 112.00 °C. @ 4.00 mm Hg
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| flash point : | 234.00 °F. TCC ( 112.22 °C. )
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| logP (o/w) : | 3.06 |
safety :
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| Oral Toxicity(LD50) : |
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Not determined
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| Dermal Toxicity(LD50) : |
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Not determined
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| Inhalation Toxicity(LC50) : |
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Not determined
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safety in use :
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| IFRA purity specification : | < 0.1% free allyl alcohol |
| recommendation for allyl salicylate usage levels up to : |
| | 0.5000 % in the fragrance concentrate.
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| recommendation for allyl salicylate usage levels up to : |
| | not for flavor use.
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safety references :
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| EPI System : | view |
| EPA Chem. Sub. Inventory : | Yes |
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| | prop-2-enyl 2-hydroxybenzoate
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| (EINECS) number : | 233-992-0 |
| chemidplus : | 010484090 |
| EPA Substance Registry Services : | 10484-09-0 |
| dtp/nci : | 408281 |
references :
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| | prop-2-enyl 2-hydroxybenzoate
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| NIST Chemistry WebBook : | 3224459720 |
| pubchem : | 208411 |
other :
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