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| IUPAC name : | ethyl 4-hydroxy-3-methoxybenzoate |
| InChI : | InChI=1/C10H12O4/c1-3-14-10(12)7-4-5-8(11)9(6-7)13-2/h4-6,11H,3H2,1-2H3 |
| InChIKey : | MWAYRGBWOVHDDZ-UHFFFAOYAS |
| SMILES : | CCOC(=O)C1=CC(=C(C=C1)O)OC |
| (EINECS) number : | 210-503-9 |
| cas number : | 617-05-0 |
| beilstein number : | 2100025 |
| coe number : | 2302 |
| fl. number : | 09.798 |
| molar refractivity : | 51.21 ± 0.3 cm3 |
| parachor : | 423.5 ± 4.0 cm3 |
| index of refraction : | 1.528 ± 0.02 |
| surface tension : | 42.1 ± 3.0 dyne/cm |
| density : | 1.180 ± 0.06 g/cm3 |
| polarizability : | 20.30 ± 0.5 10-24cm3 |
| xlogp : | 1.90 |
| molecular weight : | 196.1998800 |
| formula : | C10 H12 O4 |
| BioActivity Analysis : | 74200 |
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| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor strength : | medium ,
recommend smelling in a 10.00 % solution or less |
odor description :
at 100.00 %. | phenolic burnt guaiacol smoky powdery metallic |
| properties : | |
| appearence : | white powder |
| assay : | 96.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| melting point : | 42.00 - 44.00 °C. @ 760.00 mm Hg
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| boiling point : | 291.00 - 293.00 °C. @ 760.00 mm Hg
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| logp : | 2.31 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rabbit 3.00 gm/kg
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 252.00 °F. TCC ( 122.22 °C. )
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| recommendation for ethyl vanillate usage levels up to : |
| | 1.0000 % in the fragrance concentrate.
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| safety links : | |
| (EINECS) number : | 210-503-9 |
| chemidplus : | 000617050 |
| epa-srs : | 617-05-0 |
| dtp/nci : | 8513 |
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| other : | |
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| references : | |
| pubchem : | 155351 |
| NIST Chemistry WebBook : | 428217991 |
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